Found 6 results

Search term: GVPONLWGQFZYSV (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (1Z,2R)-2,4-Dihydroxy-N-[(3Z)-3-hydroxy-3-{[(Z)-2-sulfanylvinyl]imino}propyl]-3,3-dimethylbutanimidic acid | C11H20N2O4S

(1Z,2R)-2,4-Dihydroxy-N-[(3Z)-3-hydroxy-3-{[(Z)-2-sulfanylvinyl]imino}propyl]-3,3-dimethylbutanimidic acid

  • Molecular FormulaC11H20N2O4S
  • Average mass276.353 Da
  • Monoisotopic mass276.114380 Da
  • ChemSpider ID64873373

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(1Z,2R)-2,4-Dihydroxy-N-[(3Z)-3-hydroxy-3-{[(Z)-2-sulfanylvinyl]imino}propyl]-3,3-dimethylbutanimidic acid [ACD/IUPAC Name]
(1Z,2R)-2,4-Dihydroxy-N-[(3Z)-3-hydroxy-3-{[(Z)-2-sulfanylvinyl]imino}propyl]-3,3-dimethylbutanimidsäure [German] [ACD/IUPAC Name]
Acide (1Z,2R)-2,4-dihydroxy-N-[(3Z)-3-hydroxy-3-{[(Z)-2-sulfanylvinyl]imino}propyl]-3,3-diméthylbutanimidique [French] [ACD/IUPAC Name]
Butanimidic acid, 2,4-dihydroxy-N-[(3Z)-3-hydroxy-3-[[(Z)-2-mercaptoethenyl]imino]propyl]-3,3-dimethyl-, (1Z,2R)- [ACD/Index Name]
PANTOTHENOYLAMINOETHENETHIOL

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

Density: 1.3±0.1 g/cm3
Boiling Point: 531.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 92.9±6.0 kJ/mol
Flash Point: 275.4±32.9 °C
Index of Refraction: 1.550
Molar Refractivity: 70.2±0.5 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.22
ACD/LogD (pH 5.5): -3.22
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.53
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 144 Å2
Polarizability: 27.8±0.5 10-24cm3
Surface Tension: 44.5±7.0 dyne/cm
Molar Volume: 220.6±7.0 cm3

Click to predict properties on the Chemicalize site


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