ChemSpider 2D Image | N-[(2R)-1-(L-Asparaginylamino)-1-carboxy-2-propanyl]-L-histidine | C14H22N6O6

N-[(2R)-1-(L-Asparaginylamino)-1-carboxy-2-propanyl]-L-histidine

  • Molecular FormulaC14H22N6O6
  • Average mass370.361 Da
  • Monoisotopic mass370.160095 Da
  • ChemSpider ID78442707

  • defined stereocentres - 3 of 4 defined stereocentres

More details:

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

L-Histidine, N-[(1R)-2-carboxy-2-[[(2S)-2,4-diamino-1,4-dioxobutyl]amino]-1-methylethyl]- [ACD/Index Name]
N-[(2R)-1-(L-Asparaginylamino)-1-carboxy-2-propanyl]-L-histidin [German] [ACD/IUPAC Name]
N-[(2R)-1-(L-Asparaginylamino)-1-carboxy-2-propanyl]-L-histidine [ACD/IUPAC Name]
N-[(2R)-1-(L-Asparaginylamino)-1-carboxy-2-propanyl]-L-histidine [French] [ACD/IUPAC Name]

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

FR-900490 [DBID]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 890.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 135.5±3.0 kJ/mol
Flash Point: 492.1±34.3 °C
Index of Refraction: 1.608
Molar Refractivity: 87.3±0.3 cm3
#H bond acceptors: 12
#H bond donors: 9
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: -1.63
ACD/LogD (pH 5.5): -5.53
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.70
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 214 Å2
Polarizability: 34.6±0.5 10-24cm3
Surface Tension: 79.3±3.0 dyne/cm
Molar Volume: 252.3±3.0 cm3

Click to predict properties on the Chemicalize site


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