Cas no 1378599-69-9 (ethyl 3-amino-4-methylheptanoate)

ethyl 3-amino-4-methylheptanoate structure
1378599-69-9 structure
Product Name:ethyl 3-amino-4-methylheptanoate
CAS No:1378599-69-9
MF:C10H21NO2
MW:187.27924323082
CID:5816109
PubChem ID:165607831
Update Time:2024-01-14

ethyl 3-amino-4-methylheptanoate Chemical and Physical Properties

Names and Identifiers

    • ethyl 3-amino-4-methylheptanoate
    • 1378599-69-9
    • EN300-1284992
    • Inchi: 1S/C10H21NO2/c1-4-6-8(3)9(11)7-10(12)13-5-2/h8-9H,4-7,11H2,1-3H3
    • InChI Key: UTFCRXVRKRBHAJ-UHFFFAOYSA-N
    • SMILES: O(CC)C(CC(C(C)CCC)N)=O

Computed Properties

  • Exact Mass: 187.157228913g/mol
  • Monoisotopic Mass: 187.157228913g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 7
  • Complexity: 148
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.8
  • Topological Polar Surface Area: 52.3?2

ethyl 3-amino-4-methylheptanoate Pricemore >>

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