4-Hydroxybenzophenone - ≥98% , CAS No.1137-42-4

CAS: 1137-42-4 Cat. No.: H108575 Peso molecular: 198.22 Beilstein Registry Number: 777776 Número EC: 214-507-1

GRADE & PURITY ≥98%

Synonyms

Benzophenone, 4-hydroxy- | Methanone, (4-hydroxyphenyl)phenyl- | 1-(4-Hydroxyphenyl)-1-phenylmethanone | AKOS000119744 | N-(4-Hydroxylphenyl)-N'-phenylurea | 4'-Hydroxybenzophenone | 4-Hydroxybenzophenone | 4-HYDROXY-BENZOPHENONE | NCGC00258781-01 | PD065

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Sinónimos

Benzophenone, 4-hydroxy- | Methanone, (4-hydroxyphenyl)phenyl- | 1-(4-Hydroxyphenyl)-1-phenylmethanone | AKOS000119744 | N-(4-Hydroxylphenyl)-N'-phenylurea | 4'-Hydroxybenzophenone | 4-Hydroxybenzophenone | 4-HYDROXY-BENZOPHENONE | NCGC00258781-01 | PD065

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Argon charged, Room temperature

Enviado en

Normal

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 488181984
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488181984
• Sonrisas canónicas: C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)O
• IUPAC Name: (4-hydroxyphenyl)-phenylmethanone
• InChIKey: NPFYZDNDJHZQKY-UHFFFAOYSA-N
• INCHI: 1S/C13H10O2/c14-12-8-6-11(7-9-12)13(15)10-4-2-1-3-5-10/h1-9,14H
• Isómeros SMILES: C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)O
• WGK Alemania: 2
• RTECS: PC4959775
• Peso molecular: 198.22
• Beilstein: 777776
• Reaxy-Rn: 777776
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=777776&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Benzene and substituted derivatives
      • Subclass Benzophenones

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Benzophenones
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzophenones
• Alternative Parents: Diphenylmethanes Aryl-phenylketones Benzoyl derivatives 1-hydroxy-2-unsubstituted benzenoids Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Benzophenone - Aryl-phenylketone - Diphenylmethane - Aryl ketone - Benzoyl - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Ketone - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as benzophenones. These are organic compounds containing a ketone attached to two phenyl groups.
• External Descriptors: benzophenones

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Objetivos asociados (humanos)

AR Tclin Androgen Receptor (11781 Activities)

Discover Target: AR

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

CCF-STTG1 (114 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Objetivos asociados (no humanos)

Leishmania amazonensis (3813 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: Insoluble in water.
• Sensibilidad: light & Moisture sensitive
• Punto de fusión (°C): 132-135°C
• Peso molecular: 198.220 g/mol
• XLogP3: 3.100
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 198.068 Da
• Monoisotopic Mass: 198.068 Da
• Topological Polar Surface Area: 37.300 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 211.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Referencias

1. Shihua Mao, Wei Liu, Zeming Xie, Dong Zhang, Jiahui Zhou, Yisheng Xu, Baiping Fu, Si Yu Zheng, Ling Zhang, Jintao Yang.  (2023)  In Situ Growth of Functional Hydrogel Coatings by a Reactive Polyurethane for Biomedical Devices.  ACS Applied Materials & Interfaces,      [PMID:38036509] [10.1021/acsami.3c10683]

2. Yijia Yu, Shengjie Liu, Wenjuan Xia, Zhichen Zhu, Wenjin Wang, Chuanjiang Zhou, Zhaoqiang Wu, Hong Chen.  (2023)  Fabrication of ionic liquid-functionalized aliphatic polycarbonate brushes for self-polishing antibacterial application.  APPLIED SURFACE SCIENCE,      [PMID:] [10.1016/j.apsusc.2023.158157]

3. Yan Jia, Lili Xu, Lancheng Wang, Kun Yan, Jieru Chen, Pengcheng Xu, Bin Di, Fang Yan, Chi Hu.  (2023)  A light-up fluorescence probe for wash-free analysis of Mu-opioid receptor and ligand-binding events.  ANALYTICA CHIMICA ACTA,      [PMID:37147056] [10.1016/j.aca.2023.341220]

4. Wei Zhao, Zixue Li, Na Liang, Jiyang Liu, Pengfei Yan, Shaoping Sun.  (2022)  AIE-Featured Redox-Sensitive Micelles for Bioimaging and Efficient Anticancer Drug Delivery.  INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES,  23  (18): (10801).  [PMID:36142713] [10.3390/ijms231810801]

5. Junping Lv, Lin Zhu, Meng Zhang, Zexu Zhao, Shu-Wei Chen, Jinyi Wang.  (2022)  Polypyrrole-Cl@poly(N-isopropylacrylamide) composite-based humidity and near infrared dual-response actuators.  POLYMER,      [PMID:] [10.1016/j.polymer.2022.124669]

6. Chao Deng, Farzad Seidi, Qiang Yong, Xiangyu Jin, Chengcheng Li, Xing Zhang, Jingquan Han, Yuqian Liu, Yang Huang, Yuyan Wang, Zhenghong Yuan, Huining Xiao.  (2021)  Antiviral/antibacterial biodegradable cellulose nonwovens as environmentally friendly and bioprotective materials with potential to minimize microplastic pollution.  JOURNAL OF HAZARDOUS MATERIALS,      [PMID:34879581] [10.1016/j.jhazmat.2021.127391]

7. Haohui Shi, Na Liang, Jiyang Liu, Siyi Li, Xianfeng Gong, Pengfei Yan, Shaoping Sun.  (2021)  AIE-active polymeric micelles based on modified chitosan for bioimaging-guided targeted delivery and controlled release of paclitaxel.  CARBOHYDRATE POLYMERS,      [PMID:34294339] [10.1016/j.carbpol.2021.118327]

8. Saisai Yan, Zhinong Gao, Jia Han, Zhengqin Zhang, Fei Niu, Yingfang Zhang.  (2019)  Controllable fabrication of stimuli-responsive fluorescent silica nanoparticles using a tetraphenylethene-functionalized carboxylate gemini surfactant.  Journal of Materials Chemistry C,  7  (40): (12588-12600).  [PMID:] [10.1039/C9TC03732B]

9. Wenqing Li, Rong Wang, Zilin Chen.  (2019)  Metal-organic framework-1210(zirconium/cuprum) modified magnetic nanoparticles for solid phase extraction of benzophenones in soil samples.  JOURNAL OF CHROMATOGRAPHY A,      [PMID:31378523] [10.1016/j.chroma.2019.460403]

10. Tao Guan, Zhukang Du, Xueyi Chang, Dongli Zhao, Shurui Yang, Ning Sun, Biye Ren.  (2019)  A reactive hydrophobically modified ethoxylated urethane (HEUR) associative polymer bearing benzophenone terminal groups: Synthesis, thickening and photo-initiating reactivity.  POLYMER,      [PMID:] [10.1016/j.polymer.2019.121552]

11. Saisai Yan, Zhinong Gao, Yan Xia, Xueming Liao, Yifan Chen, Jia Han, Chenchen Pan, Yingfang Zhang.  (2018)  A Tetraphenylethene Luminogen-Functionalized Gemini Surfactant for Simple and Controllable Fabrication of Hollow Mesoporous Silica Nanorods with Enhanced Fluorescence.  INORGANIC CHEMISTRY,      [PMID:30345765] [10.1021/acs.inorgchem.8b02252]

12. Shuailing Huang, Yinglong Wu, Fang Zeng, Junjie Chen, Shuizhu Wu.  (2018)  A turn-on fluorescence probe based on aggregation-induced emission for leucine aminopeptidase in living cells and tumor tissue.  ANALYTICA CHIMICA ACTA,      [PMID:30119736] [10.1016/j.aca.2018.05.032]

13. Saisai Yan, Zhinong Gao, Yan Xia, Xueming Liao, Jia Han, Chenchen Pan, Yingfang Zhang, Wenzhong Zhai.  (2018)  Aggregation-Induced Emission Gemini Surfactant-Assisted Fabrication of Shape-Controlled Fluorescent Hollow Mesoporous Silica Nanoparticles.  EUROPEAN JOURNAL OF INORGANIC CHEMISTRY,  2018  (18): (1891-1901).  [PMID:] [10.1002/ejic.201800280]

14. Junhuai Xu, Rui Yan, Haibo Wang, Zongliang Du, Jun Gu, Xu Cheng, Junjie Xiong.  (2018)  A novel biocompatible zwitterionic polyurethane with AIE effect for cell imaging in living cells.  RSC Advances,  8  (13): (6798-6804).  [PMID:35540359] [10.1039/C7RA13238G]

15. Dandan Ge, Yi Zhang, Yixiu Dai, Shumin Yang.  (2017)  Air-assisted dispersive liquid–liquid microextraction based on a new hydrophobic deep eutectic solvent for the preconcentration of benzophenone-type UV filters from aqueous samples.  JOURNAL OF SEPARATION SCIENCE,  41  (7): (1635-1643).  [PMID:29282887] [10.1002/jssc.201701282]

16. Tong Zhang, Bo Jiang, Yudong Huang.  (2017)  UV-curable photosensitive silicone resins based on a novel polymerizable photoinitiator and GO-modified TiO2 nanoparticles.  COMPOSITES PART B-ENGINEERING,      [PMID:] [10.1016/j.compositesb.2017.12.006]

17. Shan Jiang, Wei Wang, Tianya Huang, Jie Ma, Yonghong Ding, Qiang Yu.  (2017)  Microporous membrane fabricated by AMS-GMA-TPE terpolymer grafted polypropylene prepared via extrusion.  JOURNAL OF APPLIED POLYMER SCIENCE,  135  (11): (46020).  [PMID:] [10.1002/app.46020]

18. Huiqi Wang, Zheng Li, Wei Feng, Qiong Jia.  (2017)  Polymer monolith containing an embedded covalent organic framework for the effective enrichment of benzophenones.  NEW JOURNAL OF CHEMISTRY,  41  (21): (13043-13050).  [PMID:] [10.1039/C7NJ02512B]

19. Haibo Wang, Gongyan Liu, Shihua Dong, Junjie Xiong, Zongliang Du, Xu Cheng.  (2015)  A pH-responsive AIE nanoprobe as a drug delivery system for bioimaging and cancer therapy.  Journal of Materials Chemistry B,  3  (37): (7401-7407).  [PMID:32262766] [10.1039/C5TB01169H]

20. Teng Ma, Zheng Li, Qian Niu, Yuanyuan Li, Weihong Zhou.  (2015)  Double dispersant-assisted ionic liquid dispersive liquid–liquid microextraction coupled with capillary electrophoresis for the determination of benzophenone-type ultraviolet filters in sunscreen cosmetic product.  ELECTROPHORESIS,  36  (20): (2530-2537).  [PMID:26105533] [10.1002/elps.201500004]

21. Honghe Song, Yuheng Jiang, Caixiang Chen, Shumei Wen, Zhenzhen Zhou, Chenghu Yan, Wei Cong.  (2024)  Durable photobioreactor antibiofouling coatings for microalgae cultivation by photoreactive poly(2,2,2-trifluoroethyl methacrylate).  BIOFOULING,      [PMID:39212053] [10.1080/08927014.2024.2391000]

22. Ziwei Yuan, Meng Xie, Jianlei Qian, Wenjie Fan, Menglu Li, Liao Guo, Yan Sun, Wenxin Fu.  (2024)  Low-temperature-curable and photo-patternable benzocyclobutene-derived aggregation-induced emission-active polymer dielectrics.  Aggregate,      [PMID:] [10.1002/agt2.487]

23. Yijia Yu, Wenjuan Xia, Wenjin Wang, Zhaoqiang Wu, Hong Chen.  (2024)  PEG-functionalized aliphatic polycarbonate brushes with self-polishing dynamic antifouling properties.  COLLOIDS AND SURFACES B-BIOINTERFACES,      [PMID:38703556] [10.1016/j.colsurfb.2024.113936]

24. Siyi Li, Kexin Li, Xianfeng Gong, Pengfei Yan, Shaoping Sun.  (2024)  pH-Induced color changeable AIE-featured polymeric micelles for self-indicating anticancer drug delivery.  SENSORS AND ACTUATORS B-CHEMICAL,      [PMID:] [10.1016/j.snb.2024.136637]

25. Xiaoyi Song, Fan Yang, Ruixuan Ji, Bin Yang, Yin Lv, Zhong Wei.  (2024)  ROS-responsive polymeric micelles with aggregation-induced emission effects for drug delivery and cellular imaging.  NEW JOURNAL OF CHEMISTRY,      [PMID:] [10.1039/D3NJ05245A]

26. Na Liang, Wei Zhao, Siyi Li, Xiaoxin Li, Zhenrong Liu, Kun Jiang, Shaoping Sun.  (2024)  Tumor targeting pH-triggered fluorescence-switchable hyaluronic acid-based micelles with aggregation-induced emission activity for tracing drug release and intelligent drug delivery.  INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES,      [PMID:39111498] [10.1016/j.ijbiomac.2024.134386]

27. Gaopeng Wang, Zeming Xie, Wenli Yu, Shihua Mao, Shuaibing Wang, Si Yu Zheng, Jintao Yang.  (2024)  A Double-Layer Polyurethane Electrospun Membrane with Directional Sweat Transport Ability for Use as a Soft Strain Sensor.  ACS Applied Materials & Interfaces,      [PMID:39229668] [10.1021/acsami.4c10854]

28. Jun Wang, Yinglong Wu, Fang Zeng, Shuailing Huang, Shuizhu Wu.  (2016)  AIE fluorophore with enhanced cellular uptake for tracking esterase-activated release of taurine and ROS scavenging.  FARADAY DISCUSSIONS,  196  (335-350).  [PMID:27892561] [10.1039/C6FD00118A]

29. Zhe Zong, Wei Zhao, Siyi Li, Na Liang, Shaoping Sun.  (2025)  Hydroxypropyl-β-Cyclodextrin-Based Micelles With Aggregation-Induced Emission Activity and Redox-Responsiveness for Smart Cancer Therapy.  JOURNAL OF APPLIED POLYMER SCIENCE,      [PMID:] [10.1002/app.57394]

30. Yangcheng Liu, Baoli Xu, Shengxue Wang, Qilin Liu, Zheng Xiang, Wanwei Jiang, Yang Wang.  (2025)  Constructing rice grain–dotted accordion-like TB–COF@NH₂–MXene to promote the simultaneous efficient elimination and sensitive detection of benzophenones.  FOOD CHEMISTRY,      [PMID:41475205] [10.1016/j.foodchem.2025.147715]