Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 2-Hexyldecanoic acid
RN: 25354-97-6
UNII: 49M19XFI8B
InChIKey: JMOLZNNXZPAGBH-UHFFFAOYSA-N

Note

  • Viscous oil.

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H32-O2

Molecular Weight

  • 256.427
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Regulatory Agencies (Superlist Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • 2-Hexyldecanoic acid

Synonyms

  • 2-Hexyldecanoic acid
  • 2-Hexyldecansaeure
  • 2-Hexyldecansaeure [German]
  • 4-02-00-01189 (Beilstein Handbook Reference)
  • 7-Pentadecanecarboxylic acid
  • BRN 1777217
  • C16 Guerbet fatty acid
  • EINECS 246-885-9
  • UNII-49M19XFI8B

Systematic Names

  • 2-Hexyldecanoic acid
  • Decanoic acid, 2-hexyl-

Registry Numbers

CAS Registry Number

  • 25354-97-6

FDA UNII

  • 49M19XFI8B

Other Registry Numbers

  • 1094212-97-1
  • 53593-96-7

System Generated Number

  • 0025354976

Structure Descriptors

InChI

1S/C16H32O2/c1-3-5-7-9-10-12-14-15(16(17)18)13-11-8-6-4-2/h15H,3-14H2,1-2H3,(H,17,18)

InChIKey

JMOLZNNXZPAGBH-UHFFFAOYSA-N

Smiles

C([C@@H](CCCCCC)C(O)=O)CCCCCCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD oral > 1gm/kg (1000mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 3, Pg. 86, 1953.
rat LDLo intraperitoneal 300mg/kg (300mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 3, Pg. 86, 1953.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point < 25 deg C   EXP
log P (octanol-water) 6.890 (none)   EST
Atmospheric OH Rate Constant 1.95E-11 cm3/molecule-sec 25 EST

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