1-(2-chloro-6-fluoro-phenyl)propan-1-amine - ≥97% , CAS No.1270463-49-4

CAS: 1270463-49-4 Cat. No.: P628034 Molecular Weight: 187.64 PubChem CID: 55270992

GRADE & PURITY ≥97%

Synonyms

1-(2-Chloro-6-fluorophenyl)propan-1-amine | 1270463-49-4 | (1S)-1-(2-chloro-6-fluorophenyl)propan-1-amine | 1-(2-Chloro-6-fluoro-phenyl)propan-1-amine | AKOS006319992 | BS-52467 | Y11569

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

1-(2-Chloro-6-fluorophenyl)propan-1-amine | 1270463-49-4 | (1S)-1-(2-chloro-6-fluorophenyl)propan-1-amine | 1-(2-Chloro-6-fluoro-phenyl)propan-1-amine | AKOS006319992 | BS-52467 | Y11569

Specifications & Purity

≥97%

Storage

Room temperature

Shipped In

Normal

Purity

≥97%

Names and Identifiers

• Canonical Smiles: CCC(C1=C(C=CC=C1Cl)F)N
• IUPAC Name: 1-(2-chloro-6-fluorophenyl)propan-1-amine
• InChIKey: KNPHOMUTQLDOAF-UHFFFAOYSA-N
• INCHI: 1S/C9H11ClFN/c1-2-8(12)9-6(10)4-3-5-7(9)11/h3-5,8H,2,12H2,1H3
• Isomeric SMILES: CCC(C1=C(C=CC=C1Cl)F)N
• PubChem CID: 55270992
• Molecular Weight: 187.64

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Class Benzene and substituted derivatives
      • Subclass Phenylpropylamines

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Benzene and substituted derivatives
• Subclass: Phenylpropylamines
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylpropylamines
• Alternative Parents: Phenylpropanes Fluorobenzenes Chlorobenzenes Aralkylamines Aryl fluorides Aryl chlorides Organofluorides Organochlorides Monoalkylamines Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Phenylpropylamine - Phenylpropane - Chlorobenzene - Fluorobenzene - Aralkylamine - Halobenzene - Aryl chloride - Aryl fluoride - Aryl halide - Organohalogen compound - Primary aliphatic amine - Primary amine - Hydrocarbon derivative - Organic nitrogen compound - Amine - Organochloride - Organofluoride - Organonitrogen compound - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as phenylpropylamines. These are compounds containing a phenylpropylamine moiety, which consists of a phenyl group substituted at the third carbon by an propan-1-amine.
• 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