(S)-(+)-1-Cyclohexylethylamine - ≥98%(GC) , CAS No.17430-98-7

CAS: 17430-98-7 Cat. No.: S161320 Molecular Weight: 127.23 Beilstein Registry Number: 2935070 EC Number: 629-006-7 PubChem CID: 5325951

GRADE & PURITY ≥98%(GC)

Synonyms

KBio2_007055 | N-((S)-1-cyclohexyl-ethyl)amine | EN300-112650 | (1S)-1-(cyclohexyl)ethylamine | Prestwick0_000446 | BDBM50028637 | AKOS015840729 | AS-41203 | (s)-1-cyclohexylethan-1-amine | (S)-1-cyclohexylethylamine | (S)-1-cyclohexyl-ethylamine | 1-Cycl

Storage

Room temperature,Argon charged

Shipped In

Normal

Overview

(S)-(+)-1-Cyclohexylethylamine is a chiral amine.

Specifications

Synonyms

KBio2_007055 | N-((S)-1-cyclohexyl-ethyl)amine | EN300-112650 | (1S)-1-(cyclohexyl)ethylamine | Prestwick0_000446 | BDBM50028637 | AKOS015840729 | AS-41203 | (s)-1-cyclohexylethan-1-amine | (S)-1-cyclohexylethylamine | (S)-1-cyclohexyl-ethylamine | 1-Cycl

Specifications & Purity

≥98%(GC)

Storage

Room temperature, Argon charged

Shipped In

Normal

Purity

≥98%(GC)

Names and Identifiers

• Pubchem Sid: 504763623
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504763623
• Canonical Smiles: CC(C1CCCCC1)N
• IUPAC Name: (1S)-1-cyclohexylethanamine
• InChIKey: XBWOPGDJMAJJDG-ZETCQYMHSA-N
• INCHI: 1S/C8H17N/c1-7(9)8-5-3-2-4-6-8/h7-8H,2-6,9H2,1H3/t7-/m0/s1
• Isomeric SMILES: C[C@@H](C1CCCCC1)N
• WGK Germany: 3
• PubChem CID: 5325951
• Molecular Weight: 127.23
• Beilstein: 2935070
• Reaxy-Rn: 2935070

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Class Organonitrogen compounds
      • Subclass Amines
        • Level5 Primary amines
          • Level6 Monoalkylamines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Class: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Primary amines
• Direct Parent: Monoalkylamines
• Alternative Parents: Hydrocarbon derivatives
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Hydrocarbon derivative - Primary aliphatic amine - Aliphatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as monoalkylamines. These are organic compounds containing an primary aliphatic amine group.
• 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

Mechanisms of Action

Chemical and Physical Properties

• Sensitivity: Moisture & Air sensitive
• Refractive Index: 1.46
• Specific Rotation[α]: 3.3° (neat)
• Flash Point(°F): 125.6 °F
• Flash Point(°C): 52°C(lit.)
• Boil Point(°C): 74°C/20mmHg(lit.)
• Molecular Weight: 127.230 g/mol
• XLogP3: 2.100
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 127.136 Da
• Monoisotopic Mass: 127.136 Da
• Topological Polar Surface Area: 26.000 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 74.600
• 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: 1

References

1. Siying Yu, Songbing Zhong, Dongming Song, Zixiang Yu, Jiajie Bi, Shijing Yan, Shun Wang, Yihuang Chen, Shuang Pan.  (2025)  Efficient Green Emission of Circularly Polarized Luminescence from Chiral Ruddlesden-Popper Perovskites Stabilized in Mesoporous Silica with Alloyed Spacer Cations.  Nanoscale,      [PMID:41221781] [10.1039/D5NR02656C]