(1S,4S,5R)-1-isopropyl-4-methylbicyclo[3.1.0]hexan-3-one

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(1S,4S,5R)-1-isopropyl-4-methylbicyclo[3.1.0]hexan-3-one; (1~S,4~S,5R)-4-methyl-1-propan-2-ylbicyclo[3.1.0]hexan-3-one; tanacetone; thujone; (+)-β-thujone; β-thujone
Links:🌍 Wikipedia, 📖 PubMed,
📖Org. Chem., v. Richter, 1. Vol (Thujone); p. 423,
CAS RN:[1125-12-8]
Formula:C10H16O; 152.24 g/mol
InChiKey:USMNOWBWPHYOEA-XKSSXDPKSA-N
SMILES:CC(C)[C@@]12C[C@@H]1[C@H](C)C(=O)C2
Molecular structure of (1S,4S,5R)-1-isopropyl-4-methylbicyclo[3.1.0]hexan-3-one
Odor:main fragrance of tansy oil
Retetion Index:1 089 (HP5MS)
Toxicology (LD50):240 mg/Kg (rat, ip)
Density:0.918 g/mL
Molar volume:165.8 mL/mol
Refractive index:1.452
Molecular refractive power:44.74 mL/mol
Dielectric constant:10.80
Boiling point:202 °C

Isomers

1-adamantanol
Molecular structure of 1-adamantanol
2-adamantanol
Molecular structure of 2-adamantanol
camphor
Molecular structure of camphor
d-camphor
Molecular structure of d-camphor
(1S)-camphor
Molecular structure of (1S)-camphor
caron
Molecular structure of caron
carvenone
Molecular structure of carvenone
(-)-carveol
Molecular structure of (-)-carveol
α-cyclocitral
Molecular structure of a-cyclocitral
2-cyclopentylcyclopentan-1-one
Molecular structure of 2-cyclopentylcyclopentan-1-one
trans,trans-2,4-decadienal
Molecular structure of trans,trans-2,4-decadienal
trans-1-decalone
Molecular structure of trans-1-decalone
trans-2-decalone
Molecular structure of trans-2-decalone
(+)-dihydrocarvone
Molecular structure of (+)-dihydrocarvone
dihydrocarvone
Molecular structure of dihydrocarvone
(1S,4S)-dihydrocarvone
Molecular structure of (1S,4S)-dihydrocarvone
(1R)-6,6-dimethylbicyclo[3.1.1]hept-2-ene-2-methanol
Molecular structure of (1R)-6,6-dimethylbicyclo[3.1.1]hept-2-ene-2-methanol
(2E)-3,7-dimethyl-2,6-octadienal
Molecular structure of (2E)-3,7-dimethyl-2,6-octadienal
(Z)-3,7-dimethyl-2,6-octadienal
Molecular structure of (Z)-3,7-dimethyl-2,6-octadienal
(3E)-3,7-dimethylocta-3,6-dienal
Molecular structure of (3E)-3,7-dimethylocta-3,6-dienal
2,6-dimethyl-3,5,7-octatriene-2-ol
Molecular structure of 2,6-dimethyl-3,5,7-octatriene-2-ol
3,7-dimethyloct-6-en-1-yn-3-ol
Molecular structure of 3,7-dimethyloct-6-en-1-yn-3-ol
(1R)-(-)-fenchone
Molecular structure of (1R)-(-)-fenchone
fenchone
Molecular structure of fenchone
1-formyl-2,6,6-trimethylcyclohexene
Molecular structure of 1-formyl-2,6,6-trimethylcyclohexene
ipsdienol
Molecular structure of ipsdienol
(2S,5S)-5-isopropenyl-2-methylcyclohexanone
Molecular structure of (2S,5S)-5-isopropenyl-2-methylcyclohexanone
(5R)-2-isopropylidene-5-methylcyclohexanone
Molecular structure of (5R)-2-isopropylidene-5-methylcyclohexanone
(1S,4R)-1-isopropyl-4-methylbicyclo[3.1.0]hexan-3-one
Molecular structure of (1S,4R)-1-isopropyl-4-methylbicyclo[3.1.0]hexan-3-one
(1S,4S,5R)-1-isopropyl-4-methylbicyclo[3.1.0]hexan-3-one
Molecular structure of (1S,4S,5R)-1-isopropyl-4-methylbicyclo[3.1.0]hexan-3-one
5-isopropyl-2-methyl-2-cyclohexenone
Molecular structure of 5-isopropyl-2-methyl-2-cyclohexenone
isothujone
Molecular structure of isothujone
(+)-limonene 1,2-epoxide
Molecular structure of (+)-limonene 1,2-epoxide
limonene-10-ol
Molecular structure of limonene-10-ol
4-methylene-2-(2-methylprop-1-en-1-yl)tetrahydro-2H-pyran
Molecular structure of 4-methylene-2-(2-methylprop-1-en-1-yl)tetrahydro-2H-pyran
(1S,5R)-4-methyl-1-propan-2-ylbicyclo[3.1.0]hexan-3-one
Molecular structure of (1S,5R)-4-methyl-1-propan-2-ylbicyclo[3.1.0]hexan-3-one
(5S)-2-methyl-5-propan-2-ylcyclohex-2-en-1-one
Molecular structure of (5S)-2-methyl-5-propan-2-ylcyclohex-2-en-1-one
3-methyl-5-propan-2-ylcyclohex-2-en-1-one
Molecular structure of 3-methyl-5-propan-2-ylcyclohex-2-en-1-one
(6R)-3-methyl-6-(propan-2-yl)cyclohex-2-en-1-one
Molecular structure of (6R)-3-methyl-6-(propan-2-yl)cyclohex-2-en-1-one
(6S)-3-methyl-6-propan-2-ylcyclohex-2-en-1-one
Molecular structure of (6S)-3-methyl-6-propan-2-ylcyclohex-2-en-1-one
(5S)-5-methyl-2-propan-2-ylidenecyclohexan-1-one
Molecular structure of (5S)-5-methyl-2-propan-2-ylidenecyclohexan-1-one
3-methyl-6-propan-2-ylidenecyclohex-2-en-1-ol
Molecular structure of 3-methyl-6-propan-2-ylidenecyclohex-2-en-1-ol
2-(2-methyl-2-propenyl)cyclohexanone
Molecular structure of 2-(2-methyl-2-propenyl)cyclohexanone
3-methyl-5-propylcyclohex-2-en-1-one
Molecular structure of 3-methyl-5-propylcyclohex-2-en-1-one
perillyl alcohol
Molecular structure of perillyl alcohol
phellandral
Molecular structure of phellandral
α-pinene oxide
Molecular structure of a-pinene oxide
(-)-trans-pinocarveol
Molecular structure of (-)-trans-pinocarveol
piperitone
Molecular structure of piperitone
(1R-(1α,2β,4β,6α))-2,2,7-trimethyl-3-oxatricyclo[4.1.1.02,4]octane
Molecular structure of (1R-(1a,2b,4b,6a))-2,2,7-trimethyl-3-oxatricyclo[4.1.1.02,4]octane
spiro[4.5]decan-6-one
Molecular structure of spiro[4.5]decan-6-one
4,4,6,6-tetramethyl-2-cyclohexen-1-one
Molecular structure of 4,4,6,6-tetramethyl-2-cyclohexen-1-one
α-thujone
Molecular structure of a-thujone
(1S,4R)-1,3,3-trimethylbicyclo[2.2.1]heptan-2-one
Molecular structure of (1S,4R)-1,3,3-trimethylbicyclo[2.2.1]heptan-2-one
(1S,2S,5S)-4,6,6-trimethylbicyclo[3.1.1]hept-3-en-2-ol
Molecular structure of (1S,2S,5S)-4,6,6-trimethylbicyclo[3.1.1]hept-3-en-2-ol
2,6,6-trimethyl-2-cycloheptenone
Molecular structure of 2,6,6-trimethyl-2-cycloheptenone
2,6,6-trimethylcyclohexene-1-carbaldehyde
Molecular structure of 2,6,6-trimethylcyclohexene-1-carbaldehyde
4,7,7-trimethyl-6-oxabicyclo[3.2.1]oct-3-ene
Molecular structure of 4,7,7-trimethyl-6-oxabicyclo[3.2.1]oct-3-ene
cis-verbenol
Molecular structure of cis-verbenol
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