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Substance Name: 2-Butenoic acid, 2-butenylidene ester, (E,E,E)- (8CI,9CI)
RN: 10141-07-8
InChIKey: BADIPRCUJPQNIE-OTWDQPKHSA-N

Classification Code

  • Skin / Eye Irritant

Molecular Formula

  • C12-H16-O4

Molecular Weight

  • 224.254
 
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Names and Synonyms

Synonyms

  • 2-Butenylidene crotonate
  • 4-02-00-01505 (Beilstein Handbook Reference)
  • BRN 1708973
  • Crotylidene dicrotonate

Systematic Names

  • 2-Butenoic acid, 2-butenylidene ester, (E,E,E)- (8CI,9CI)
  • Crotonic acid, 2-butenylidene ester

Registry Numbers

CAS Registry Number

  • 10141-07-8

System Generated Number

  • 0010141078

Structure Descriptors

InChI

1S/C12H16O4/c1-4-7-10(13)15-12(9-6-3)16-11(14)8-5-2/h4-9,12H,1-3H3/b7-4+,8-5+,9-6+

InChIKey

BADIPRCUJPQNIE-OTWDQPKHSA-N

Smiles

C(OC(\C=C\C)=O)(OC(\C=C\C)=O)\C=C\C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 2590mg/kg (2590mg/kg)   American Industrial Hygiene Association Journal. Vol. 23, Pg. 95, 1962.