Found 1 result

Search term: InChIKey=SBEXLJDCZSJDLW-YSTUJMKBSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 2D1N3668TJ | C16H26O2

2D1N3668TJ

  • Molecular FormulaC16H26O2
  • Average mass250.376 Da
  • Monoisotopic mass250.193283 Da
  • ChemSpider ID52085576

  • Double-bond stereo - Double-bond stereo

More details:

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

(6Z,9Z,12Z)-6,9,12-Hexadecatrienoic acid [ACD/IUPAC Name]
(6Z,9Z,12Z)-6,9,12-Hexadecatriensäure [German] [ACD/IUPAC Name]
29428-96-4 [RN]
2D1N3668TJ
6,9,12-Hexadecatrienoic acid, (6Z,9Z,12Z)- [ACD/Index Name]
Acide (6Z,9Z,12Z)-6,9,12-hexadécatriénoïque [French] [ACD/IUPAC Name]
(6Z,9Z,12Z)-HEXADECA-6,9,12-TRIENOIC ACID
16:3(6Z,9Z,12Z)
6Z,9Z,12Z-hexadecatrienoic acid
C16:3n-4,7,10
More...

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

Density: 0.9±0.1 g/cm3
Boiling Point: 349.1±11.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 65.2±6.0 kJ/mol
Flash Point: 246.1±14.4 °C
Index of Refraction: 1.493
Molar Refractivity: 77.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 5.51
ACD/LogD (pH 5.5): 4.26
ACD/BCF (pH 5.5): 638.78
ACD/KOC (pH 5.5): 2063.10
ACD/LogD (pH 7.4): 2.46
ACD/BCF (pH 7.4): 10.18
ACD/KOC (pH 7.4): 32.87
Polar Surface Area: 37 Å2
Polarizability: 30.9±0.5 10-24cm3
Surface Tension: 35.0±3.0 dyne/cm
Molar Volume: 268.1±3.0 cm3

Click to predict properties on the Chemicalize site


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