Found 1 result

Search term: RDZUDQFNGNUIKH (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (5Z,9beta,11alpha,12alpha,13E,15S)-9-Chloro-11,15-dihydroxyprosta-5,13-dien-1-oic acid | C20H33ClO4

(5Z,9β,11α,12α,13E,15S)-9-Chloro-11,15-dihydroxyprosta-5,13-dien-1-oic acid

  • Molecular FormulaC20H33ClO4
  • Average mass372.927 Da
  • Monoisotopic mass372.206726 Da
  • ChemSpider ID35034181

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(5Z,9β,11α,12α,13E,15S)-9-Chlor-11,15-dihydroxyprosta-5,13-dien-1-säure [German] [ACD/IUPAC Name]
(5Z,9β,11α,12α,13E,15S)-9-Chloro-11,15-dihydroxyprosta-5,13-dien-1-oic acid [ACD/IUPAC Name]
(Z)-7-[(1r,2r,3r,5r)-5-Chloranyl-3-Oxidanyl-2-[(E,3s)-3-Oxidanyloct-1-Enyl]cyclopentyl]hept-5-Enoic Acid
Acide (5Z,9β,11α,12α,13E,15S)-9-chloro-11,15-dihydroxyprosta-5,13-dién-1-oïque [French] [ACD/IUPAC Name]
Prosta-5,13-dien-1-oic acid, 9-chloro-11,15-dihydroxy-, (5Z,9β,11α,12α,13E,15S)- [ACD/Index Name]
ON5

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

Density: 1.1±0.1 g/cm3
Boiling Point: 527.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 92.3±6.0 kJ/mol
Flash Point: 272.9±30.1 °C
Index of Refraction: 1.532
Molar Refractivity: 101.9±0.4 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 0
ACD/LogP: 3.58
ACD/LogD (pH 5.5): 2.74
ACD/BCF (pH 5.5): 45.22
ACD/KOC (pH 5.5): 313.23
ACD/LogD (pH 7.4): 0.94
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.01
Polar Surface Area: 78 Å2
Polarizability: 40.4±0.5 10-24cm3
Surface Tension: 47.2±5.0 dyne/cm
Molar Volume: 328.9±5.0 cm3

Click to predict properties on the Chemicalize site


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