Damascenone

1-(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)but-2-en-1-one

Also Known As: Damascenone|b-damascenone|beta-Damascenone|RefChem:919620|3,5,8-Megastigmatrien-7-one|CTK4F2057|CTK4F2123|POIARNZEYGURDG-UHFFFAOYSA-N|1-(2,6,6-Trimethylcyclohexa-1,3-dien-1-yl)but-2-en-1-one|2,6,6-Trimethyl-1-crotonyl-1,3-cyclohexadiene|SID:135727511|2-BUTEN-1-ONE, 1-(2,6,6-TRIMETHYL-1,3-CYCLOHEXADIEN-1-YL)-|C502869|A1201974|(E)-beta-Damascenone 1000 microg/mL in Acetonitrile|2,6,6-trimethyl-1-(but-2-enoyl)-cyclohexa-1,3-dien|1-(2,6,6-trimethylcyclohexa-1,3-dienyl) but-2-en-1one|1-(2,6,6-Trimethyl-1,3-cyclohexadien-1-yl)-2-buten-1-one|1-(2,6,6-Trimethylcyclohexa-1,3-dien-1-yl)-2-buten-1-one|2-Buten-1-one,1-(2,6,6-trimethyl-1,3-cyclohexadien-1-yl)-|(E)-1-(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)but-2-en-1-one|2-Buten-1-one, 1-(2,6,6-trimethyl-1,3-cyclohexadien-1-yl)-, (2Z)-|2-Buten-1-one,1-(2,6,6-trimethyl-1,3-cyclohexadien-1-yl)-, (2E)-|1-(2,6,6-Trimethyl-1,3-cyclohexadien-1-yl)-2-buten-1-one; 1-(2,6,6-Trimethyl-1,3-cyclohexadienyl)-2-buten-1-one; 1-Crotonoyl-2,6,6-trimethyl-1,3-cyclohexadiene; 2,6,6-Trimethyl-1-(2-butenoyl)-1,3-cyclohexadiene|2-Buten-1-one, 1-(2,6,6-trimethyl-1,3-cyclohexadien-1-yl)-; 1-(2,6,6-Trimethyl-1,3-cyclohexadien-1-yl)-2-buten-1-one; 1-(2,6,6-Trimethyl-1,3-cyclohexadienyl)-2-buten-1-one; 1-Crotonoyl-2,6,6-trimethyl-1,3-cyclohexadiene; 2,6,6-Trimethyl-1-(2-butenoyl)-1,3-cyclohexadiene; 2,6,6-Trimethyl-1-crotonyl-1,3-cyclohexadiene

Molecular Formula	C13H18O
Molecular Weight	190.13577 g/mol
LogP	3.43
Topological Polar Surface Area	17.07 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	1
Rotatable Bonds	2
Exact Mass	190.13577
Heavy Atoms	14
Complexity	327.1

Chemical Identifiers

CAS Number	23696-85-7
SMILES	CC=CC(=O)C1=C(C=CCC1(C)C)C