Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Ethyl tiglate
RN: 5837-78-5
UNII: 0MQ7E9082G
InChIKey: OAPHLAAOJMTMLY-GQCTYLIASA-N

Molecular Formula

  • C7-H12-O2

Molecular Weight

  • 128.1698
 
* 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

Results Name

  • Ethyl tiglate

Name of Substance

  • Ethyl tiglate

Synonyms

  • (E)-2-Methyl-2-butenoic acid ethyl ester
  • 2-Butenoic acid, 2-methyl-, ethyl ester, (E)-
  • 4-02-00-01553 (Beilstein Handbook Reference)
  • BRN 1720895
  • Crotonic acid, 2-methyl-, ethyl ester, (E)-
  • EINECS 227-425-6
  • Ethyl (E)-2-methyl-2-butenoate
  • Ethyl (E)-2-methylcrotonate
  • Ethyl 2-methyl-2-butenoate, (E)-
  • Ethyl 2-methylcrotonate, (E)-
  • Ethyl alpha-methylcrotonate
  • Ethyl tiglate
  • Ethyl trans-2-methyl-2-butenoate
  • Ethyl trans-2-methylcrotonate
  • FEMA No. 2460
  • NSC 55278
  • Tiglic acid, ethyl ester
  • UNII-0MQ7E9082G

Systematic Names

  • 2-Butenoic acid, 2-methyl-, ethyl ester, (2E)-
  • 2-Butenoic acid, 2-methyl-, ethyl ester, (E)-
  • Crotonic acid, 2-methyl-, ethyl ester, (E)- (8CI)
  • Ethyl 2-methylcrotonate
  • Tiglic acid, ethyl ester (6CI,7CI)

Superlist Name

  • Ethyl tiglate

Registry Numbers

CAS Registry Number

  • 5837-78-5

FDA UNII

  • 0MQ7E9082G

System Generated Number

  • 0005837785

Structure Descriptors

InChI

1S/C7H12O2/c1-4-6(3)7(8)9-5-2/h4H,5H2,1-3H3/b6-4+

InChIKey

OAPHLAAOJMTMLY-GQCTYLIASA-N

Smiles

C(=O)(/C(=C/C)C)OCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin > 5gm/kg (5000mg/kg)   Food and Chemical Toxicology. Vol. 26, Pg. 321, 1988.
rat LD50 oral > 5gm/kg (5000mg/kg)   Food and Chemical Toxicology. Vol. 26, Pg. 321, 1988.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 156 deg C   EXP
log P (octanol-water) 2.180 (none)   EST
Atmospheric OH Rate Constant 3.23E-11 cm3/molecule-sec 25 EST

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