beta-Thujone

(1S,4S,5R)-4-methyl-1-propan-2-ylbicyclo[3.1.0]hexan-3-one

Also Known As: beta-Thujone|(+)-Isothujone|d-Isothujone|Isothujone|(+)-Thujone|trans-thujone|(+)-3-Thujone|d-Thujone|D-beta-Thujone|(+)-beta-Thujone|THUJONE|-thujone|beta Thujone|cis-Thujone|3-isothujone|D-beta|.beta.-Thujone|thujone (trans-)|(Z)-Thujone|(+)-cis-Thujone|(+)-b-Thujone|(+)-|A-thujone|(+)-thujan-3-one|(1S,4S,5R)-(+)-3-thujanone|.BETA.-THUJONE [MI]|(1S,4S,5R)-thujan-3-one|3-Thujanone, (1S,4S,5R)-(+)-|AI3-11501|(+)-Isothujone ((+)-beta-Thujone)|(+)-(1S,4S,5R)-thujan-3-one|[1S,4S,5R,(+)]-Thujan-3-one|LS-1281

Molecular Formula	C10H16O
Molecular Weight	152.12012 g/mol
LogP	2.26
Topological Polar Surface Area	17.07 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	1
Rotatable Bonds	1
Exact Mass	152.12012
Heavy Atoms	11
Complexity	206.9

Chemical Identifiers

CAS Number	471-15-8
SMILES	C[C@H]1[C@H]2C[C@]2(CC1=O)C(C)C