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Substance Name: Cyclobutanone
RN: 1191-95-3
UNII: 6PF2SH405U
InChIKey: SHQSVMDWKBRBGB-UHFFFAOYSA-N

Molecular Formula

  • C4-H6-O

Molecular Weight

  • 70.0904
 
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Names and Synonyms

Name of Substance

  • Cyclobutanone

Synonyms

  • AI3-37787
  • Cyclobutanone
  • EINECS 214-745-6
  • NSC 87632
  • UNII-6PF2SH405U

Systematic Name

  • Cyclobutanone

Registry Numbers

CAS Registry Number

  • 1191-95-3

FDA UNII

  • 6PF2SH405U

System Generated Number

  • 0001191953

Structure Descriptors

InChI

1S/C4H6O/c5-4-2-1-3-4/h1-3H2

InChIKey

SHQSVMDWKBRBGB-UHFFFAOYSA-N

Smiles

C1(CCC1)=O

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -5.09E+01 deg C   EXP
Boiling Point 99 deg C   EXP
log P (octanol-water) 0.140 (none)   EST
Water Solubility 1.02E+05 mg/L 25 EST
Vapor Pressure 43 mm Hg 25 EXP
Henry's Law Constant 2.90E-05 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 8.70E-13 cm3/molecule-sec 25 EXP

Physical property data is provided to ChemIDplus by SRC, Inc.