ChemSpider 2D Image | GLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-D-ALANINE | C12H21N3O6

GLYCYL-L-α-AMINO-ε-PIMELYL-D-ALANINE

  • Molecular FormulaC12H21N3O6
  • Average mass303.312 Da
  • Monoisotopic mass303.143036 Da
  • ChemSpider ID16744177

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2R)-2-[(2-Ammonioacétyl)amino]-7-{[(1R)-1-carboxyéthyl]amino}-7-oxoheptanoate [French] [ACD/IUPAC Name]
(2R)-2-[(Ammonioacetyl)amino]-7-{[(1R)-1-carboxyethyl]amino}-7-oxoheptanoat [German] [ACD/IUPAC Name]
(2R)-2-[(Ammonioacetyl)amino]-7-{[(1R)-1-carboxyethyl]amino}-7-oxoheptanoate [ACD/IUPAC Name]
Ethanaminium, 2-[[(1R)-1-carboxy-6-[[(1R)-1-carboxyethyl]amino]-6-oxohexyl]amino]-2-oxo-, inner salt [ACD/Index Name]
GLYCYL-L-α-AMINO-ε-PIMELYL-D-ALANINE
(2R)-2-(2-ammonioacetamido)-6-{[(1R)-1-carboxyethyl]carbamoyl}hexanoate
(2R)-2-(2-azaniumylacetamido)-6-{[(1R)-1-carboxyethyl]carbamoyl}hexanoate

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

PH7 [DBID]

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

Density:
Boiling Point: 712.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.9 mmHg at 25°C
Enthalpy of Vaporization: 113.5±6.0 kJ/mol
Flash Point: 385.0±32.9 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 9
#H bond donors: 6
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: -2.26
ACD/LogD (pH 5.5): -5.32
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.57
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 163 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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