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Substance Name: Isobutyl angelate
RN: 7779-81-9
UNII: 7OR98SJS39
InChIKey: XDEGQMQKHFPBEW-YVMONPNESA-N

Molecular Formula

  • C9-H16-O2

Molecular Weight

  • 156.2234
 
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Names and Synonyms

Name of Substance

  • Isobutyl angelate

Synonyms

  • 2-Butenoic acid, 2-methyl-, 2-methylpropyl ester, (Z)-
  • 2-Methylpropyl 2-methyl-2-butenoate, (Z)-
  • Angelic acid, isobutyl ester
  • Crotonic acid, 2-methyl-, isobutyl ester, (Z)-
  • EINECS 231-941-7
  • FEMA No. 2180
  • Isobutyl 2-methylcrotonoate, (Z)-
  • Isobutyl angelate
  • Isobutyl cis-2-methyl-2-butenoate
  • UNII-7OR98SJS39

Systematic Names

  • 2-Butenoic acid, 2-methyl-, 2-methylpropyl ester, (2Z)-
  • 2-Butenoic acid, 2-methyl-, 2-methylpropyl ester, (Z)-
  • Isobutyl 2-methylisocrotonate

Superlist Name

  • Isobutyl angelate

Registry Numbers

CAS Registry Number

  • 7779-81-9

FDA UNII

  • 7OR98SJS39

System Generated Number

  • 0007779819

Structure Descriptors

InChI

1S/C9H16O2/c1-5-8(4)9(10)11-6-7(2)3/h5,7H,6H2,1-4H3/b8-5-

InChIKey

XDEGQMQKHFPBEW-YVMONPNESA-N

Smiles

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