4-Aminobenzophenone - ≥98% , CAS No.1137-41-3

CAS: 1137-41-3 Cat. No.: A151497 Fórmula: C₁₃H₁₁NO Peso molecular: 197.24 Número EC: 214-506-6

GRADE & PURITY ≥98%

Synonyms

4-Aminobenzophenone | 4-amino-benzophenone | A1140 | BDBM50145839 | Q63399175 | Methanone, (4-aminophenyl)phenyl- | A803084 | (4-aminophenyl)(phenyl)methanone | (4-Amino-phenyl)phenylmethanone | (4-Amino-phenyl)-phenyl-methanone | (4-Amino-phenyl)phenyl-m

Storage

Protected from light,Room temperature,Argon charged,Desiccated

Shipped In

Normal

Descripción general

4-Aminobenzophenone is associated with 4-benzoylpyridine and it is used as a frequency doubler for semiconductor lasers. It is used in the preparation of 1-[4-[N,N-bis(trimethylsilyl)amino]phenyl]-1-phenylethylene. It is used as a precursor to prepare 1,2,3-triazoles, pyrimidotriazoles, benzothiazole and pyrimidinone derivatives. It is involved in the formation of coordination complexes with chromium(III).

Specifications

Sinónimos

4-Aminobenzophenone | 4-amino-benzophenone | A1140 | BDBM50145839 | Q63399175 | Methanone, (4-aminophenyl)phenyl- | A803084 | (4-aminophenyl)(phenyl)methanone | (4-Amino-phenyl)phenylmethanone | (4-Amino-phenyl)-phenyl-methanone | (4-Amino-phenyl)phenyl-m

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Protected from light,Room temperature,Argon charged,Desiccated

Enviado en

Normal

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 488181983
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488181983
• Sonrisas canónicas: C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)N
• IUPAC Name: (4-aminophenyl)-phenylmethanone
• InChIKey: RBKHNGHPZZZJCI-UHFFFAOYSA-N
• INCHI: 1S/C13H11NO/c14-12-8-6-11(7-9-12)13(15)10-4-2-1-3-5-10/h1-9H,14H2
• Isómeros SMILES: C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)N
• Peso molecular: 197.24
• Reaxy-Rn: 389292
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=389292&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 Aniline and substituted anilines Primary amines Organopnictogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Benzophenone - Diphenylmethane - Aryl-phenylketone - Aniline or substituted anilines - Aryl ketone - Benzoyl - Ketone - Organic oxide - Hydrocarbon derivative - Primary amine - Organooxygen compound - Organonitrogen compound - Amine - Organic nitrogen compound - Organopnictogen compound - Organic oxygen 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: Not available

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

Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: Soluble in cold water, alcohol and ether.
• Sensibilidad: Air sensitive;Light sensitive
• Punto de ebullición (°C): 245-247℃/22mm
• Punto de fusión (°C): 121-124 °C
• Peso molecular: 197.230 g/mol
• XLogP3: 2.700
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 197.084 Da
• Monoisotopic Mass: 197.084 Da
• Topological Polar Surface Area: 43.100 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 213.000
• 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. Yulei Gao, Qiannan Zhang, Fenfen Wang, Pingchuan Sun.  (2023)  Wide-range tunable phosphorescence emission in cellulose-based materials enabled by complementary-color phosphors.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2023.144665]

2. Yangcen Ou, Xiaofei Wang, Nan He, Xiao Wang, Dan Lu, Zhen Li, Feng Luo, Jiehua Li, Hong Tan.  (2023)  A biocompatible polyurethane fluorescent emulsion with aggregation-induced emission for targeted tumor imaging.  Journal of Materials Chemistry B,  11  (10): (2266-2275).  [PMID:36799348] [10.1039/D2TB02608B]

3. Yibo Yan, Long Jiang, Song Zhang, Xiantao Shen, Chuixiu Huang.  (2022)  Specific “light-up” sensor made easy: An aggregation induced emission monomer for molecular imprinting.  BIOSENSORS & BIOELECTRONICS,      [PMID:35219945] [10.1016/j.bios.2022.114113]

4. Zhijian Mai, Hao Li, Yixun Gao, Yue Niu, Yongrui Li, Nicolaas Frans de Rooij, Ahmad Umar, M. S. Al-Assiri, Yao Wang, Guofu Zhou.  (2020)  Synergy of CO2-response and aggregation induced emission in a small molecule: renewable liquid and solid CO2 chemosensors with high sensitivity and visibility.  ANALYST,  145  (10): (3528-3534).  [PMID:32190881] [10.1039/D0AN00189A]

5. Yi Hu, Leilei Shi, Yue Su, Chuan Zhang, Xin Jin, Xinyuan Zhu.  (2017)  A fluorescent light-up aggregation-induced emission probe for screening gefitinib-sensitive non-small cell lung carcinoma.  Biomaterials Science,  5  (4): (792-799).  [PMID:28265596] [10.1039/C7BM00035A]

6. Yaning Gao, Yin Wang, Jinhui Jiang, Ping Wei, Hui Sun.  (2025)  Triggered “On/off” Luminescent Polypeptide Bowl-Shaped Nanoparticles for Selective Lighting of Tumor Cells.  Small,      [PMID:39888201] [10.1002/smll.202411432]