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Substance Name: 2-Decalone
RN: 4832-17-1
UNII: 157GES295F
InChIKey: LGVJRKCQQHOWAU-UHFFFAOYSA-N

Molecular Formula

  • C10-H16-O

Molecular Weight

  • 152.235
 
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Names and Synonyms

Name of Substance

  • 2-Decalone

Synonyms

  • EINECS 225-411-4
  • UNII-157GES295F

Systematic Name

  • Bicyclo(4.4.0)decan-2-one

Registry Numbers

CAS Registry Number

  • 4832-17-1

FDA UNII

  • 157GES295F

System Generated Number

  • 0004832171

Structure Descriptors

InChI

1S/C10H16O/c11-10-6-5-8-3-1-2-4-9(8)7-10/h8-9H,1-7H2

InChIKey

LGVJRKCQQHOWAU-UHFFFAOYSA-N

Smiles

C1[C@@H]2[C@@H](CCC1=O)CCCC2

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 1.97 (none)   EXP
Water Solubility 1540 mg/L 25 EST
Vapor Pressure 0.096 mm Hg 25 EST
Henry's Law Constant 7.00E-05 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.69E-11 cm3/molecule-sec 25 EST

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