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Substance Name: Ethyl 10-undecenoate
RN: 692-86-4
UNII: 7P1S77T8BF
InChIKey: FXNFFCMITPHEIT-UHFFFAOYSA-N

Classification Code

  • Skin / Eye Irritant

Molecular Formula

  • C13-H24-O2

Molecular Weight

  • 212.331
 
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Names and Synonyms

Name of Substance

  • Ethyl 10-undecenoate

Synonyms

  • 10-Undecenoic acid, ethyl ester
  • 4-02-00-01614 (Beilstein Handbook Reference)
  • AI3-00664
  • BRN 1769949
  • EINECS 211-734-8
  • Ethyl 10-hendecenoate
  • Ethyl 10-undecenoate
  • Ethyl 10-undecylenate
  • Ethyl undecenoate
  • Ethyl undecylenate
  • FEMA No. 2461
  • UNII-7P1S77T8BF

Systematic Names

  • 10-Undecenoic acid, ethyl ester
  • Ethyl undec-10-enoate

Superlist Name

  • Ethyl 10-undecenoate

Registry Numbers

CAS Registry Number

  • 692-86-4

FDA UNII

  • 7P1S77T8BF

Other Registry Numbers

  • 36118-46-4
  • 62453-48-9

System Generated Number

  • 0000692864

Structure Descriptors

InChI

1S/C13H24O2/c1-3-5-6-7-8-9-10-11-12-13(14)15-4-2/h3H,1,4-12H2,2H3

InChIKey

FXNFFCMITPHEIT-UHFFFAOYSA-N

Smiles

C(CCCCCCCC=C)C(OCC)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin > 5gm/kg (5000mg/kg)   Food and Chemical Toxicology. Vol. 20, Pg. 687, 1982.
rat LD50 oral > 5gm/kg (5000mg/kg)   Food and Chemical Toxicology. Vol. 20, Pg. 687, 1982.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -3.80E+01 deg C   EXP
Boiling Point 264.5 deg C   EXP
log P (octanol-water) 5.150 (none)   EST
Atmospheric OH Rate Constant 3.79E-11 cm3/molecule-sec 25 EST

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