Found 1 result

Search term: 78439932 (Found by CSID)
ChemSpider 2D Image | (3Z,6R,7R,9Z,12Z)-7-Chloro-3,9,12-pentadecatrien-1-yn-6-ol | C15H21ClO

(3Z,6R,7R,9Z,12Z)-7-Chloro-3,9,12-pentadecatrien-1-yn-6-ol

  • Molecular FormulaC15H21ClO
  • Average mass252.780 Da
  • Monoisotopic mass252.128098 Da
  • ChemSpider ID78439932

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3Z,6R,7R,9Z,12Z)-7-Chlor-3,9,12-pentadecatrien-1-in-6-ol [German] [ACD/IUPAC Name]
(3Z,6R,7R,9Z,12Z)-7-Chloro-3,9,12-pentadecatrien-1-yn-6-ol [ACD/IUPAC Name]
(3Z,6R,7R,9Z,12Z)-7-Chloro-3,9,12-pentadécatrién-1-yn-6-ol [French] [ACD/IUPAC Name]
3,9,12-Pentadecatrien-1-yn-6-ol, 7-chloro-, (3Z,6R,7R,9Z,12Z)- [ACD/Index Name]
(3E,9Z,12Z)-7-Chloro-3,9,12-pentadecatrien-1-yn-6-ol [ACD/IUPAC Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 366.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 71.0±6.0 kJ/mol
Flash Point: 175.7±27.9 °C
Index of Refraction: 1.518
Molar Refractivity: 75.8±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 4.50
ACD/LogD (pH 5.5): 4.16
ACD/BCF (pH 5.5): 861.34
ACD/KOC (pH 5.5): 4391.38
ACD/LogD (pH 7.4): 4.16
ACD/BCF (pH 7.4): 861.34
ACD/KOC (pH 7.4): 4391.37
Polar Surface Area: 20 Å2
Polarizability: 30.1±0.5 10-24cm3
Surface Tension: 37.5±3.0 dyne/cm
Molar Volume: 250.4±3.0 cm3

Click to predict properties on the Chemicalize site


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