β-Patchoulene, 96.88%

cas: 514-51-2 — see every product listed under this CAS number, including other names

β-Patchoulene, 96.88% (CAS 514-51-2) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.

brandMedChemExpress
catalog numberHY-N12378-Get quote
cas514-51-2
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properties

delivery time over 3 weeks
purity96.88%
Structural formula: {0} (CAS {1})

Beta-patchoulene is a sesquiterpene that is a side product of patchoulol synthase from Pogostemon cablin.

Source: ChEBI

Identity
Molecular formulaC15H24
Molecular weight204.35 g/mol
IUPAC name(1R,5S,8R)-1,5,11,11-tetramethyltricyclo[6.2.1.02,6]undec-2(6)-ene
InChIKeyCSKINCSXMLCMAR-RWSFTLGLSA-N
SMILESC[C@H]1CCC2=C1C[C@H]3CC[C@@]2(C3(C)C)C

Computed by PubChem (NCBI)

Synonyms: (1R,5S,8R)-1,5,11,11-tetramethyltricyclo[6.2.1.02,6]undec-2(6)-ene, (1R,5S,8R)-1,5,11,11-tetramethyltricyclo(6.2.1.02,6)undec-2(6)-ene, (1S,4R,7R)-1,4,9,9-Tetramethyl-1,2,3,4,5,6,7,8-octahydro-4,7-methanoazulene, Patschulen, |?-Patchoulene, orb1944075, CSKINCSXMLCMAR-RWSFTLGLSA-N
Isomers (same molecular formula)
(3R,4aS,5R)-4a,5-dimethyl-3-prop-1-en-2-yl-2,3,4,5,6,7-hexahydro-1H-naphthalene C15H24
(3E,6E)-3,7,11-trimethyldodeca-1,3,6,10-tetraene C15H24
cis-(1S,2S)-1-ethenyl-1-methyl-4-propan-2-ylidene-2-prop-1-en-2-ylcyclohexane C15H24
(1R,2S,7S,9S)-3,3,7-trimethyl-8-methylidenetricyclo[5.4.0.02,9]undecane C15H24
(1aR,7R,7aS,7bR)-1,1,4,7-tetramethyl-1a,2,3,5,6,7,7a,7b-octahydrocyclopropa[e]azulene C15H24
1,3,5-tri(propan-2-yl)benzene C15H24
1-methyl-4-(6-methylhept-5-en-2-ylidene)cyclohexene C15H24
(1S,2R,5S,7S)-2,6,6,8-tetramethyltricyclo[5.3.1.01,5]undec-8-ene C15H24
nonylbenzene C15H24
(1E,4E,8E)-2,6,6,9-tetramethylcycloundeca-1,4,8-triene C15H24
(1aR,4aR,7R,7aR,7bS)-1,1,7-trimethyl-4-methylidene-2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[e]azulene C15H24
(1R,8S)-2,2,7,7-tetramethyltricyclo[6.2.1.01,6]undec-5-ene C15H24

Also listed as

β-Patchoulene TargetMol CAS 514-51-2
beta-Patchoulene Biosynth CAS 514-51-2

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