Product Name

  • Name

    2-AMINOHEPTANOIC ACID

  • EINECS
  • CAS No. 1115-90-8
  • Article Data21
  • CAS DataBase
  • Density 1.017 g/cm3
  • Solubility
  • Melting Point 280 °C (dec.)
  • Formula C7H15NO2
  • Boiling Point 250.954 °C at 760 mmHg
  • Molecular Weight 145.20
  • Flash Point 105.574 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 1115-90-8 (2-AMINOHEPTANOIC ACID)
  • Hazard Symbols
  • Synonyms Heptanoicacid, 2-amino-, (?à)-;Heptanoic acid, 2-amino-, DL- (8CI);DL-Homonorleucine;Heptyline;Homonorleucine;NSC 20146;a-DL-Aminoheptanoic acid;
  • PSA 63.32000
  • LogP 1.67890

2-Aminoheptanoic acid Specification

The Heptanoic acid,2-amino-, with the CAS registry number 1115-90-8, has the systematic name of 2-aminoheptanoic acid. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C7H15NO2.

The characteristics of Heptanoic acid,2-amino- are as followings: (1)ACD/LogP: 1.45; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.05; (4)ACD/LogD (pH 7.4): -1.05; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 29.54 Å2; (13)Index of Refraction: 1.465; (14)Molar Refractivity: 39.53 cm3; (15)Molar Volume: 142.7 cm3; (16)Polarizability: 15.67×10-24cm3; (17)Surface Tension: 39.9 dyne/cm; (18)Density: 1.017 g/cm3; (19)Flash Point: 105.6 °C; (20)Enthalpy of Vaporization: 53.76 kJ/mol; (21)Boiling Point: 251 °C at 760 mmHg; (22)Vapour Pressure: 0.00664 mmHg at 25°C.   

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=C(O)C(N)CCCCC
(2)InChI: InChI=1/C7H15NO2/c1-2-3-4-5-6(8)7(9)10/h6H,2-5,8H2,1H3,(H,9,10)
(3)InChIKey: RDFMDVXONNIGBC-UHFFFAOYAG

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