ChemSpider 2D Image | canavaninosuccinate | C9H16N4O7

canavaninosuccinate

  • Molecular FormulaC9H16N4O7
  • Average mass292.246 Da
  • Monoisotopic mass292.101898 Da
  • ChemSpider ID35032414

More details:

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

56073-32-6 [RN]
Acide N-[N-(3-amino-3-carboxypropoxy)carbamimidoyl]aspartique [French] [ACD/IUPAC Name]
Aspartic acid, N-[[(3-amino-3-carboxypropoxy)amino]iminomethyl]- [ACD/Index Name]
Aspartic acid, N-[[(3-amino-3-carboxypropoxy)amino]iminomethyl]-, (S)-
canavaninosuccinate
N-[N-(3-Amino-3-carboxypropoxy)carbamimidoyl]asparaginsäure [German] [ACD/IUPAC Name]
N-[N-(3-Amino-3-carboxypropoxy)carbamimidoyl]aspartic acid [ACD/IUPAC Name]
2-[1-(3-amino-3-carboxypropoxy)carbamimidamido]butanedioic acid
2-[3-(3-amino-3-carboxypropoxy)carbamimidamido]butanedioic acid
2-[N`-(3-AMINO-3-CARBOXYPROPOXY)CARBAMIMIDAMIDO]BUTANEDIOIC ACID
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

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

Density: 1.7±0.1 g/cm3
Boiling Point: 513.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 85.9±6.0 kJ/mol
Flash Point: 264.3±32.9 °C
Index of Refraction: 1.626
Molar Refractivity: 60.5±0.5 cm3
#H bond acceptors: 11
#H bond donors: 8
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: -1.07
ACD/LogD (pH 5.5): -4.79
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.53
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 195 Å2
Polarizability: 24.0±0.5 10-24cm3
Surface Tension: 78.9±7.0 dyne/cm
Molar Volume: 170.8±7.0 cm3

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