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Substance Name: Cyclododecanone
RN: 830-13-7
UNII: WL053118A9
InChIKey: SXVPOSFURRDKBO-UHFFFAOYSA-N

Molecular Formula

  • C12-H22-O

Molecular Weight

  • 182.3048
 
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Names and Synonyms

Name of Substance

  • Cyclododecanone

Synonyms

  • Cyclododecanone
  • EC 212-595-6
  • EINECS 212-595-6
  • HSDB 5762
  • NSC 77116
  • UNII-WL053118A9

Systematic Name

  • Cyclododecanone

Superlist Name

  • Cyclododecanone

Registry Numbers

CAS Registry Number

  • 830-13-7

FDA UNII

  • WL053118A9

System Generated Number

  • 0000830137

Structure Descriptors

InChI

1S/C12H22O/c13-12-10-8-6-4-2-1-3-5-7-9-11-12/h1-11H2

InChIKey

SXVPOSFURRDKBO-UHFFFAOYSA-N

Smiles

C1(=O)CCCCCCCCCCC1

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 59 deg C   EXP
log P (octanol-water) 4.1 (none)   EXP
Water Solubility 16.9 mg/L 25 EST
Henry's Law Constant 2.80E-04 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.06E-11 cm3/molecule-sec 25 EST

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