Cas no 143826-97-5 (Heptanamide, 5-methyl-)

Heptanamide, 5-methyl- structure
Heptanamide, 5-methyl- structure
Product Name:Heptanamide, 5-methyl-
CAS No:143826-97-5
MF:C8H17NO
MW:143.226682424545
CID:200231
PubChem ID:177806
Update Time:2025-04-19

Heptanamide, 5-methyl- Chemical and Physical Properties

Names and Identifiers

    • Heptanamide, 5-methyl-
    • 5-methylheptanamide
    • 5-Methylheptanimidic acid
    • DTXSID60932116
    • 143826-97-5
    • AKOS006361340
    • SCHEMBL16539159
    • SCHEMBL22485400
    • Inchi： 1S/C8H17NO/c1-3-7(2)5-4-6-8(9)10/h7H,3-6H2,1-2H3,(H2,9,10)
    • InChI Key： PVDIWSSUJZTYJS-UHFFFAOYSA-N
    • SMILES： O=C(CCCC(C)CC)N

Computed Properties

  • Exact Mass: 143.13111
  • Monoisotopic Mass: 143.131014
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 5
  • Complexity: 101
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 43.1
  • XLogP3: 1.8

Experimental Properties

  • Density: 0.885
  • Boiling Point: 274.6°C at 760 mmHg
  • Flash Point: 119.9°C
  • Refractive Index: 1.44
  • PSA: 43.09

Heptanamide, 5-methyl- Related Literature

  • 1. Novel approach of adaptive laboratory evolution: triggers defense molecules in Streptomyces sp. against targeted pathogen
    Sudarshan Singh Rathore,Vigneshwari Ramamurthy,Sally Allen,S. Selva Ganesan,Jayapradha Ramakrishnan RSC Adv. 2016 6 96250
  • 2. 790. The identities of the antibiotics colistin and polymyxin E
    S. Wilkinson,L. A. Lowe J. Chem. Soc. 1964 4107

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