ChemSpider 2D Image | Methyl 3-oxetanylideneacetate | C6H8O3

Methyl 3-oxetanylideneacetate

  • Molecular FormulaC6H8O3
  • Average mass128.126 Da
  • Monoisotopic mass128.047348 Da
  • ChemSpider ID24571193

More details:

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

1105665-34-6 [RN]
2-(3-oxetanylidene)acetic acid methyl ester
3-Oxétanylidèneacétate de méthyle [French] [ACD/IUPAC Name]
Acetic acid, 2-(3-oxetanylidene)-, methyl ester [ACD/Index Name]
methyl 2-(3-oxetanylidene)acetate
Methyl 2-(oxetan-3-ylidene)acetate
Methyl 3-oxetanylideneacetate [ACD/IUPAC Name]
Methyl oxetan-3-ylideneacetate
Methyl-3-oxetanylidenacetat [German] [ACD/IUPAC Name]
MFCD16140399 [MDL number]
More...

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

CCRIS 4693 [DBID]
  • Miscellaneous

    • Safety:

      23-26-37-60 Alfa Aesar H57376
      36/37/38 Alfa Aesar H57376
      H315-H319-H335 Alfa Aesar H57376
      P261-P280-P305+P351+P338-P304+P340-P405-P501a Alfa Aesar H57376
      Warning Alfa Aesar H57376

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

Density: 1.3±0.1 g/cm3
Boiling Point: 188.2±33.0 °C at 760 mmHg
Vapour Pressure: 0.6±0.4 mmHg at 25°C
Enthalpy of Vaporization: 42.4±3.0 kJ/mol
Flash Point: 69.1±20.0 °C
Index of Refraction: 1.574
Molar Refractivity: 32.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.15
ACD/LogD (pH 5.5): 0.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 26.64
ACD/LogD (pH 7.4): 0.09
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 26.64
Polar Surface Area: 36 Å2
Polarizability: 13.0±0.5 10-24cm3
Surface Tension: 55.2±3.0 dyne/cm
Molar Volume: 99.2±3.0 cm3

Click to predict properties on the Chemicalize site


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