ChemSpider 2D Image | (3S)-3-[Amino(~13~C)methyl]-5-methyl(1,2-~13~C_2_)hexanoic acid | C513C3H17NO2

(3S)-3-[Amino(13C)methyl]-5-methyl(1,2-13C2)hexanoic acid

  • Molecular FormulaC513C3H17NO2
  • Average mass162.204 Da
  • Monoisotopic mass162.135986 Da
  • ChemSpider ID58785360
  • defined stereocentres - 1 of 1 defined stereocentres

    Non-standard isotope - Non-standard isotope


More details:






Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(3S)-3-[Amino(13C)methyl]-5-methyl(1,2-13C2)hexanoic acid [ACD/IUPAC Name]
(3S)-3-[Amino(13C)methyl]-5-methyl(1,2-13C2)hexansäure [German] [ACD/IUPAC Name]
Acide (3S)-3-[amino(13C)méthyl]-5-méthyl(1,2-13C2)hexanoïque [French] [ACD/IUPAC Name]
Hexanoic-1,2-13C2 acid, 3-(aminomethyl-13C)-5-methyl-, (3S)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.0±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.465
Molar Refractivity: 44.1±0.3 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 17.5±0.5 10-24cm3
Surface Tension: 37.9±3.0 dyne/cm
Molar Volume: 159.6±3.0 cm3

Click to predict properties on the Chemicalize site






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