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Substance Name: Methyl decanoate
RN: 110-42-9
UNII: U9L2W51J0B
InChIKey: YRHYCMZPEVDGFQ-UHFFFAOYSA-N

Molecular Formula

  • C11-H22-O2

Molecular Weight

  • 186.2928
 
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Names and Synonyms

Name of Substance

  • Methyl decanoate

Synonyms

  • 4-02-00-01044 (Beilstein Handbook Reference)
  • AI3-26168
  • BRN 1759170
  • Capric acid methyl ester
  • CCRIS 673
  • Decanoic acid, methyl ester
  • EC 203-766-6
  • EINECS 203-766-6
  • HSDB 5399
  • Metholene 2095
  • Methyl caprate
  • Methyl caprinate
  • Methyl decanoate
  • Methyl decanoate (natural)
  • Methyl n-caprate
  • Methyl n-decanoate
  • Methyl-n-caprate
  • NSC 3713
  • UNII-U9L2W51J0B
  • Uniphat A30

Systematic Names

  • Decanoic acid, methyl ester
  • Methyl decanoate

Superlist Name

  • Decanoic acid, methyl ester

Registry Numbers

CAS Registry Number

  • 110-42-9

FDA UNII

  • U9L2W51J0B

System Generated Number

  • 0000110429

Structure Descriptors

InChI

1S/C11H22O2/c1-3-4-5-6-7-8-9-10-11(12)13-2/h3-10H2,1-2H3

InChIKey

YRHYCMZPEVDGFQ-UHFFFAOYSA-N

Smiles

C(CCCCCCCC)C(=O)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intravenous 48mg/kg (48mg/kg)   Journal of the Reticuloendothelial Society. Vol. 3, Pg. 250, 1966.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -1.80E+01 deg C   EXP
Boiling Point 224 deg C   EXP
log P (octanol-water) 4.41 (none)   EXP
Water Solubility 4.4 mg/L 20 EXP
Vapor Pressure 0.037 mm Hg 25 EXP
Henry's Law Constant 2.06E-03 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.04E-11 cm3/molecule-sec 25 EST

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