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470-40-6

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470-40-6 Structure

470-40-6 Structure
IdentificationBack Directory
[Name]

(-)-THUJOPSEN
[CAS]

470-40-6
[Synonyms]

Widdrene
Nsc 44707
Sesquichamene
(-)-THUJOPSEN
(-)-THUJOPSENE
(Z)-Thujopsene
cis-thujopsene
THUJOPSEN, (-)-
Einecs 207-426-8
cis-(-)-Thujopsene
THUJOPSEN, (-)-(SG)
THUJOPSEN, (-)-(SG)(CALL)
cyclopropa[d]naphthalene,
4abeta,8atheta)]-as-(1aalph
(-)-Thujopsene >=97.0% (GC)
(1S,6S,10S)-2,2,6,9-TETRAMETHYL-TRICYCLO[8.1.0.0(1.6)]UNDEC-8-ENE
(1S,6S,10S)-2,2,6,9-Tetramethyl-1,10-methanobicyclo[4.4.0]deca-8-ene
2,4a,8,8-Tetramethyl-1,1a,4,4a,5,6,7,8-octahydrocyclopropa[d]naphthalene
1,1a,4,4a,5,6,7,8-octahydro-2,4a,8,8-tetramethyl-cyclopropa[d]naphthalen[1
(1aS,8aS)-1,1aα,4,4a,5,6,7,8-Octahydro-2,4aβ,8,8-tetramethylcyclopropa[d]naphthalene
[1aS,4aS,8aS,(-)]-1,1a,4,4a,5,6,7,8-Octahydro-2,4aβ,8,8-tetramethylcyclopropa[d]naphthalene
Cyclopropa[d]naphthalene, 1,1a,4,4a,5,6,7,8-octahydro-2,4a,8,8-tetramethyl-, (1aS,4aS,8aS)-(-)-
[1aS-(1aalpha,4abeta,8aR*)]-1,1a,4,4a,5,6,7,8-octahydro-2,4a,8,8-tetramethylcyclopropa[d]naphthalene
Cyclopropa[d]naphthalene, 1,1a,4,4a,5,6,7,8-octahydro-2,4a,8,8-tetramethyl-, [1aS-(1aalpha,4abeta,8aR*)]-
[EINECS(EC#)]

207-426-8
[Molecular Formula]

C15H24
[MDL Number]

MFCD00042960
[MOL File]

470-40-6.mol
[Molecular Weight]

204.35
Chemical PropertiesBack Directory
[Melting point ]

<25 °C
[alpha ]

D -110° (c = 2 in chloroform)
[Boiling point ]

258-260 °C(lit.)
[density ]

0.936 g/mL at 20 °C(lit.)
[refractive index ]

n20/D 1.505
[Fp ]

104°C
[storage temp. ]

Amber Vial, Refrigerator, Under inert atmosphere
[solubility ]

Chloroform (Sparingly), Dichloromethane (Slightly)
[form ]

Oil
[color ]

Colourless
[BRN ]

1907465
[LogP]

6.053 (est)
[EPA Substance Registry System]

Cyclopropa[d]naphthalene, 1,1a,4,4a,5,6,7,8-octahydro-2,4a,8,8-tetramethyl-, (1aS,4aS,8aS)- (470-40-6)
Hazard InformationBack Directory
[Definition]

ChEBI: A thujopsene that has (S,S,S)-configuration.
[Uses]

(-)-Thujopsene is an essential oil.
Safety DataBack Directory
[Safety Statements ]

23-24/25
[RIDADR ]

1993
[WGK Germany ]

3
[HazardClass ]

3.2
[PackingGroup ]

III
Spectrum DetailBack Directory
[Spectrum Detail]

(-)-THUJOPSEN(470-40-6)MS
(-)-THUJOPSEN(470-40-6)IR1
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