(S)-1-amino-3-chloro-2-propanol hydrochloride - ≥98% , CAS No.34839-13-9

CAS: 34839-13-9 Cat. No.: S192900 Peso molecular: 146.02 Número EC: 810-453-3 PubChem CID: 135010

GRADE & PURITY ≥98%

Synonyms

AMY31075 | 1-AMINO-3-CHLORO-2-PROPANOL HYDROCHLORIDE, (-)- | 2-Propanol, 1-amino-3-chloro-, hydrochloride, (S)- | AKOS016011935 | CL-88236 | Velopural | (S)-1-Amino-3-chloro-2-propanol hydrochloride | (S)-1-Amino-3-chloropropan-2-olhydrochloride | (S)-1-A

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

AMY31075 | 1-AMINO-3-CHLORO-2-PROPANOL HYDROCHLORIDE, (-)- | 2-Propanol, 1-amino-3-chloro-, hydrochloride, (S)- | AKOS016011935 | CL-88236 | Velopural | (S)-1-Amino-3-chloro-2-propanol hydrochloride | (S)-1-Amino-3-chloropropan-2-olhydrochloride | (S)-1-A

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 488187829
• Sonrisas canónicas: C(C(CCl)O)N.Cl
• IUPAC Name: (2S)-1-amino-3-chloropropan-2-ol;hydrochloride
• InChIKey: ZCPJBHYNOFIAPJ-AENDTGMFSA-N
• INCHI: 1S/C3H8ClNO.ClH/c4-1-3(6)2-5;/h3,6H,1-2,5H2;1H/t3-;/m1./s1
• Isómeros SMILES: C([C@@H](CCl)O)N.Cl
• PubChem CID: 135010
• Peso molecular: 146.02

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • Clase Halohydrins
      • Subclass Chlorohydrins

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Clase: Halohydrins
• Subclass: Chlorohydrins
• Intermediate Tree Nodes: Not available
• Direct Parent: Chlorohydrins
• Alternative Parents: Secondary alcohols Organopnictogen compounds Organochlorides Monoalkylamines Hydrochlorides Hydrocarbon derivatives Alkyl chlorides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Secondary alcohol - Chlorohydrin - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Hydrochloride - Organooxygen compound - Organonitrogen compound - Organochloride - Primary aliphatic amine - Alkyl halide - Alkyl chloride - Alcohol - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as chlorohydrins. These are alcohols substituted by a chlorine atom at a saturated carbon atom otherwise bearing only hydrogen or hydrocarbyl 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

Propiedades químicas y físicas

• Peso molecular: 146.010 g/mol
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 145.006 Da
• Monoisotopic Mass: 145.006 Da
• Topological Polar Surface Area: 46.300 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 34.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 1
• 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

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