clorhidrato de cloruro de 3-(dimetilamino)propilo - ≥98%(T) , CAS No.5407-04-5

CAS: 5407-04-5 Cat. No.: D154697 Peso molecular: 158.07 Beilstein Registry Number: 4148 Número EC: 226-467-2 PubChem CID: 94308

GRADE & PURITY ≥98%(T)

Synonyms

(3-chloropropyl)dimethylamine hydrochloride | (3-chloro-propyl)-dimethylamine hydrochloride | (3-chloro-propyl)-dimethyl-amine hydrochloride | (3chloro-propyl)-dimethyl-amine hydrochloride | 1-Chloro-3-(dimethylamino)propane hydrochloride | 3-Chloro-N',N'

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Sinónimos

(3-chloropropyl)dimethylamine hydrochloride | (3-chloro-propyl)-dimethylamine hydrochloride | (3-chloro-propyl)-dimethyl-amine hydrochloride | (3chloro-propyl)-dimethyl-amine hydrochloride | 1-Chloro-3-(dimethylamino)propane hydrochloride | 3-Chloro-N', N'

Especificaciones y pureza

≥98%(T)

Condiciones de almacenamiento de almacenamiento

Argon charged, Room temperature

Enviado en

Normal

Pureza

≥98%(T)

Nombres e identificadores

• Sonrisas canónicas: CN(C)CCCCl.Cl
• IUPAC Name: 3-chloro-N,N-dimethylpropan-1-amine;hydrochloride
• InChIKey: LJQNMDZRCXJETK-UHFFFAOYSA-N
• INCHI: 1S/C5H12ClN.ClH/c1-7(2)5-3-4-6;/h3-5H2,1-2H3;1H
• Isómeros SMILES: CN(C)CCCCl.Cl
• RTECS: UI0209950
• PubChem CID: 94308
• Peso molecular: 158.07
• Beilstein: 4148
• Reaxy-Rn: 3670046

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Clase Organonitrogen compounds
      • Subclass Amines
        • Level5 Tertiary amines
          • Level6 Trialkylamines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Clase: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Tertiary amines
• Direct Parent: Trialkylamines
• Alternative Parents: Organopnictogen compounds Organochlorides Hydrochlorides Hydrocarbon derivatives Alkyl chlorides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Tertiary aliphatic amine - Organopnictogen compound - Hydrocarbon derivative - Hydrochloride - Organochloride - Organohalogen compound - Alkyl halide - Alkyl chloride - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as trialkylamines. These are organic compounds containing a trialkylamine group, characterized by exactly three alkyl groups bonded to the amino nitrogen.
• 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

• Sensibilidad: Moisture sensitive
• Punto de fusión (°C): 138-144 °C
• Peso molecular: 158.070 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 157.043 Da
• Monoisotopic Mass: 157.043 Da
• Topological Polar Surface Area: 3.200 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 37.100
• 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: 2

XLogP3

Referencias

1. Zhongming Zhao, Hong Sun, Chaojie Yu, Baijun Liu, Rui Liu, Qi Yang, Bingyan Guo, Xiuqiang Li, Mengmeng Yao, Fanglian Yao, Hong Zhang, Junjie Li.  (2023)  Injectable Asymmetric Adhesive-Antifouling Bifunctional Hydrogel for Peritoneal Adhesion Prevention.  Advanced Healthcare Materials,      [PMID:38115543] [10.1002/adhm.202303574]

2. Wenkun Zhang, Ting Huang, Yu Ren, Shuai Yang, Xinyao Zhao, Maosen Yuan, Jinyi Wang, Qin Tu.  (2022)  A multifunctional chitosan composite aerogel for PPCPs adsorption.  CARBOHYDRATE POLYMERS,      [PMID:36241325] [10.1016/j.carbpol.2022.120102]

3. Zhenyuan Wang, Guangxing Pan, Binshen Wang, Ling Zhang, Weiwei Zhao, Xing Ma, Jichuan Zhang, Jiaheng Zhang.  (2019)  Synthesis and Properties of Azide-Functionalized Ionic Liquids as Attractive Hypergolic Fuels.  Chemistry-An Asian Journal,  14  (12): (2122-2128).  [PMID:30950213] [10.1002/asia.201900364]

4. Na Wen, Shaoyu Lü, Chunmei Gao, Xiubin Xu, Xiao Bai, Can Wu, Piao Ning, Mingzhu Liu.  (2017)  Glucose-responsive zwitterionic dialdehyde starch-based micelles with potential anti-phagocytic behavior for insulin delivery.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2017.10.096]

5. Qingyu Yu, Huizhong Hao, Weitong Wang, Linhua Zhang, Chenlu Huang, Jianying Hao, Xinyu Yang, Dunwan Zhu, Junjie Li, Hong Sun.  (2024)  Dynamic and photodegradable dextran/gelatin hydrogel niche crosslinked with disulfide bonds: Promoting growth and release of stem cells.  INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES,      [PMID:39746418] [10.1016/j.ijbiomac.2024.139430]

6. Hongying Li, Qingtao Zeng, Limei Tan, Chenran Zhen, Xiaoyu Zhang, Longgang Wang, Xifa Lan, Haiyan Xiao.  (2025)  Zwitterionic daptomycin mineralized gold nanoflowers based nanodrugs for enhanced anti-glioma therapy.  COLLOIDS AND SURFACES A-PHYSICOCHEMICAL AND ENGINEERING ASPECTS,      [PMID:] [10.1016/j.colsurfa.2025.137957]

7. Yuqin Zhou, Shihan Du, Kailun He, Beilei Zhou, Zixuan Chen, Cheng Zheng, Minghao Zhou, Jue Li, Yue Chen, Hu Zhang, Hong Yuan, Yinghong Li, Yan Chen, Fuqiang Hu.  (2025)  Daptomycin-Loaded Nano-Drug Delivery System Based on Biomimetic Cell Membrane Coating Technology: Preparation, Characterization, and Evaluation.  Pharmaceuticals,  18  (8): (1169).  [PMID:40872560] [10.3390/ph18081169]

8. Nannan Zhang, Hongkai Tian, Wenyi Zong, Qingao Fan, Jinlian Hua, Jinyi Wang, Qin Tu.  (2025)  Chitosan based cryogel loaded with zeolitic imidazolate framework-67 and glucose oxidase enabling hemostasis and diabetic wound healing.  CARBOHYDRATE POLYMERS,      [PMID:40441826] [10.1016/j.carbpol.2025.123709]