ChemSpider 2D Image | N-(Methoxycarbonyl)-D-valine | C7H13NO4

N-(Methoxycarbonyl)-D-valine

  • Molecular FormulaC7H13NO4
  • Average mass175.182 Da
  • Monoisotopic mass175.084457 Da
  • ChemSpider ID32740478
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

D-Valine, N-(methoxycarbonyl)- [ACD/Index Name]
N-(Methoxycarbonyl)-D-valin [German] [ACD/IUPAC Name]
N-(Methoxycarbonyl)-D-valine [ACD/IUPAC Name]
N-(Méthoxycarbonyl)-D-valine [French] [ACD/IUPAC Name]
(2R)-2-(methoxycarbonylamino)-3-methylbutanoic acid
(2R)-2-[(methoxycarbonyl)amino]-3-methylbutanoic acid
(r)-(+)-n-(methoxycarbonyl)valine
(R)-2-((Methoxycarbonyl)amino)-3-methylbutanoic acid
(R)-2-(methoxycarbonylamino)-3-methylbutanoic acid
(S)-2-((Methoxycarbonyl)amino)-3-methylbutanoic acid
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 315.9±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 61.3±6.0 kJ/mol
Flash Point: 144.9±23.2 °C
Index of Refraction: 1.457
Molar Refractivity: 41.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.75
ACD/LogD (pH 5.5): -1.63
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.30
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 76 Å2
Polarizability: 16.4±0.5 10-24cm3
Surface Tension: 39.3±3.0 dyne/cm
Molar Volume: 151.8±3.0 cm3

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