ChemSpider 2D Image | MFCD00190345 | C713CH6


  • Molecular FormulaC713CH6
  • Average mass103.126 Da
  • Monoisotopic mass103.050308 Da
  • ChemSpider ID49071475
  • Non-standard isotope - Non-standard isotope

More details:

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

(2-13C)Ethinylbenzol [German] [ACD/IUPAC Name]
(2-13C)Ethynylbenzene [ACD/IUPAC Name]
(2-13C)Éthynylbenzène [French] [ACD/IUPAC Name]
13C Labeled phenylacetylene
54522-92-8 [RN]
Benzene, ethynyl-2-13C- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.0±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.542
Molar Refractivity: 33.8±0.4 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 13.4±0.5 10-24cm3
Surface Tension: 36.0±5.0 dyne/cm
Molar Volume: 107.4±5.0 cm3

Click to predict properties on the Chemicalize site