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Search term: HCKBZDSJLBNPGN-UITAMQMPSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | (2Z)-2-{[(2,2-Dimethylcyclopropyl)carbonyl]amino}-4-methyl-2-pentenoic acid | C12H19NO3

(2Z)-2-{[(2,2-Dimethylcyclopropyl)carbonyl]amino}-4-methyl-2-pentenoic acid

  • Molecular FormulaC12H19NO3
  • Average mass225.284 Da
  • Monoisotopic mass225.136490 Da
  • ChemSpider ID23111466

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-2-{[(2,2-Dimethylcyclopropyl)carbonyl]amino}-4-methyl-2-pentenoic acid [ACD/IUPAC Name]
(2Z)-2-{[(2,2-Dimethylcyclopropyl)carbonyl]amino}-4-methyl-2-pentensäure [German] [ACD/IUPAC Name]
2-Pentenoic acid, 2-[[(2,2-dimethylcyclopropyl)carbonyl]amino]-4-methyl-, (2Z)- [ACD/Index Name]
Acide (2Z)-2-{[(2,2-diméthylcyclopropyl)carbonyl]amino}-4-méthyl-2-penténoïque [French] [ACD/IUPAC Name]
(2Z)-2-{[(2,2-dimethylcyclopropyl)carbonyl]amino}-4-methylpent-2-enoic acid
2-[(2,2-Dimethyl-cyclopropanecarbonyl)-amino]-4-methyl-pent-2-enoic acid

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

Density: 1.1±0.1 g/cm3
Boiling Point: 428.1±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 74.9±6.0 kJ/mol
Flash Point: 212.7±26.5 °C
Index of Refraction: 1.509
Molar Refractivity: 60.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.54
ACD/LogD (pH 5.5): 0.65
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 11.17
ACD/LogD (pH 7.4): -1.09
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 66 Å2
Polarizability: 24.0±0.5 10-24cm3
Surface Tension: 41.0±3.0 dyne/cm
Molar Volume: 202.7±3.0 cm3

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