ChemSpider 2D Image | N-[(4-Cyanobenzyl)sulfonyl]glycylglycine | C12H13N3O5S

N-[(4-Cyanobenzyl)sulfonyl]glycylglycine

  • Molecular FormulaC12H13N3O5S
  • Average mass311.314 Da
  • Monoisotopic mass311.057587 Da
  • ChemSpider ID28545728

More details:

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

Glycine, N-[[(4-cyanophenyl)methyl]sulfonyl]glycyl- [ACD/Index Name]
N-[(4-Cyanbenzyl)sulfonyl]glycylglycin [German] [ACD/IUPAC Name]
N-[(4-Cyanobenzyl)sulfonyl]glycylglycine [ACD/IUPAC Name]
N-[(4-Cyanobenzyl)sulfonyl]glycylglycine [French] [ACD/IUPAC Name]
{2-[(4-CYANOPHENYL)METHANESULFONAMIDO]ACETAMIDO}ACETIC ACID
1156425-42-1 [RN]
2-(2-{[(4-cyanophenyl)methane]sulfonamido}acetamido)acetic acid
2-{2-[(4-cyanophenyl)methanesulfonamido]acetamido}acetic acid
MFCD13678384

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.611
Molar Refractivity: 72.4±0.4 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: -0.83
ACD/LogD (pH 5.5): -2.94
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.24
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 145 Å2
Polarizability: 28.7±0.5 10-24cm3
Surface Tension: 75.8±5.0 dyne/cm
Molar Volume: 208.4±5.0 cm3

Click to predict properties on the Chemicalize site


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