2,4,4-Trimethyl-3-(3-oxo-1-butenyl)cyclohex-2-en-1-one | CAS No. 27185-77-9

2,4,4-Trimethyl-3-(3-oxo-1-butenyl)cyclohex-2-en-1-one

Basic Information

CAS Number

27185-77-9

Molecular Formula

C13H18O2

Molecular Weight

206.28 g/mol

AD

Basic Physical Properties

CC1=C(C(CCC1=O)(C)C)C=CC(=O)C

InChI

InChI=1S/C13H18O2/c1-9(14)5-6-11-10(2)12(15)7-8-13(11,3)4/h5-6H,7-8H2,1-4H3/b6-5+

InChIKey

OBHGOXFSRVNKBS-AATRIKPKSA-N

LogP

2.837200000000001

Topological Polar Surface Area

34.14 Ų

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

357

Synonyms & References

English

  • 3-Oxo-b-ionone
  • 2,4,4-trimethyl-3-[(E)-3-oxo-but-1-enyl]-cyclohex-2-en-1-one
  • 2,4,4-Trimethyl-3-(3-oxo-1-butenyl)cyclohex-2-en-1-one
  • 29790-29-2
  • CHEBI:211741
  • (E)-2,4,4-Trimethyl-3-(3-oxobut-1-en-1-yl)cyclohex-2-en-1-one
  • 2,4,4-Trimethyl-3-(3-oxo-1-butenyl)-2-cyclohexen-1-one
  • EINECS 249-851-1
  • 3-Oxo-.beta.-ionone
  • SCHEMBL8390312
  • 2, 4, 4-trimethyl-3-[(E)-3-oxobut-1-enyl]cyclohex-2-en-1-one
  • 2-Cyclohexen-1-one, 2,4,4-trimethyl-3-(3-oxo-1-buten-1-yl)-
  • (E)-2,4,4-Trimethyl-3-(3-oxo-1-butenyl)cyclohex-2-en-1-one
  • 2-Cyclohexen-1-one, 2,4,4-trimethyl-3-(3-oxo-1-butenyl)-
  • 3-Keto-.beta.-ionone
  • DTXSID701017762
  • 4-Oxo-beta-ionone
  • (E)-3-oxo-beta-ionone
  • Q67879619
  • 4-Oxo-b-ionone
  • EINECS 248-307-0
  • 2,4,4-Trimethyl-3-[(1E)-3-oxo-1-butenyl]-2-cyclohexen-1-one
  • NS00085207
  • 2,4,4-trimethyl-3-[(E)-3-oxobut-1-enyl]cyclohex-2-en-1-one
  • 27185-77-9
  • 2-Cyclohexen-1-one,2,4,4-trimethyl-3-(3-oxo-1-buten-1-yl)-
  • 2,4,4-trimethyl-3-(3-oxo-1-butenyl)cyclohex-2-en-1-one
  • 3-Keto-&#946
  • -ionone

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