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Search term: 5-guanidino-3-methyl-2-oxopentanoate (Found by synonym)

ChemSpider 2D Image | 5-guanidino-3-methyl-2-oxopentanoic acid | C7H13N3O3

5-guanidino-3-methyl-2-oxopentanoic acid

  • Molecular FormulaC7H13N3O3
  • Average mass187.196 Da
  • Monoisotopic mass187.095688 Da
  • ChemSpider ID27471432

More details:






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

5-Carbamimidamido-3-methyl-2-oxopentanoic acid [ACD/IUPAC Name]
5-Carbamimidamido-3-methyl-2-oxopentansäure [German] [ACD/IUPAC Name]
5-guanidino-3-methyl-2-oxopentanoic acid
Acide 5-carbamimidamido-3-méthyl-2-oxopentanoïque [French] [ACD/IUPAC Name]
Pentanoic acid, 5-[(aminoiminomethyl)amino]-3-methyl-2-oxo- [ACD/Index Name]
5-carbamimidamido-3-methyl-2-oxopentanoic acid zwitterion
5-guanidino-3-methyl-2-oxopentanoate
5-guanidino-3-methyl-2-oxopentanoic acid zwitterion

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

CHEBI:64288 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 334.4±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 63.5±6.0 kJ/mol
Flash Point: 156.0±28.4 °C
Index of Refraction: 1.569
Molar Refractivity: 44.1±0.5 cm3
#H bond acceptors: 6
#H bond donors: 5
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: -2.08
ACD/LogD (pH 5.5): -4.19
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.19
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 116 Å2
Polarizability: 17.5±0.5 10-24cm3
Surface Tension: 56.2±7.0 dyne/cm
Molar Volume: 134.5±7.0 cm3

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