ChemSpider 2D Image | asn-asp | C8H13N3O6

asn-asp

  • Molecular FormulaC8H13N3O6
  • Average mass247.205 Da
  • Monoisotopic mass247.080429 Da
  • ChemSpider ID28639305

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

Acide L-asparaginyl-L-aspartique [French] [ACD/IUPAC Name]
asn-asp
L-Asparaginyl-L-asparaginsäure [German] [ACD/IUPAC Name]
L-Asparaginyl-L-aspartic acid [ACD/IUPAC Name]
L-Aspartic acid, L-asparaginyl- [ACD/Index Name]
(S)-2-((S)-2,4-Diamino-4-oxobutanamido)succinic acid
61365-15-9 [RN]
L-Asn-L-Asp
Nd [Formula]
N-D

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

Density: 1.5±0.1 g/cm3
Boiling Point: 640.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.1 mmHg at 25°C
Enthalpy of Vaporization: 103.2±6.0 kJ/mol
Flash Point: 341.1±31.5 °C
Index of Refraction: 1.571
Molar Refractivity: 52.9±0.3 cm3
#H bond acceptors: 9
#H bond donors: 7
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: -2.04
ACD/LogD (pH 5.5): -5.35
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.29
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 173 Å2
Polarizability: 21.0±0.5 10-24cm3
Surface Tension: 82.3±3.0 dyne/cm
Molar Volume: 161.0±3.0 cm3

Click to predict properties on the Chemicalize site


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