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Substance Name: Dodecanoic acid, 1-methylethyl ester
RN: 10233-13-3
UNII: U0JQ94LABM
InChIKey: UJPPXNXOEVDSRW-UHFFFAOYSA-N

Molecular Formula

  • C15-H30-O2

Molecular Weight

  • 242.4
 
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Names and Synonyms

Name of Substance

  • 1-Methylethyl dodecanoate
  • Dodecanoic acid, 1-methylethyl ester
  • Isopropyl laurate

Synonyms

  • EC 233-560-1
  • EINECS 233-560-1
  • iso-Propyl dodecanoate
  • UNII-U0JQ94LABM

Systematic Names

  • Dodecanoic acid, 1-methylethyl ester
  • Isopropyl laurate

Registry Numbers

CAS Registry Number

  • 10233-13-3

FDA UNII

  • U0JQ94LABM

System Generated Number

  • 0010233133

Structure Descriptors

InChI

1S/C15H30O2/c1-4-5-6-7-8-9-10-11-12-13-15(16)17-14(2)3/h14H,4-13H2,1-3H3

InChIKey

UJPPXNXOEVDSRW-UHFFFAOYSA-N

Smiles

C(CCCCCCCCCC)C(OC(C)C)=O

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 6.190 (none)   EST
Water Solubility 0.134 mg/L 25 EST
Henry's Law Constant 5.25E-03 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.64E-11 cm3/molecule-sec 25 EST

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