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940280-80-8

940280-80-8 Structure

940280-80-8 Structure
IdentificationBack Directory
[Name]

(3aS,6aS)-1,3a,4,6a-tetrahydro-3,6-diphenylpentalene
[CAS]

940280-80-8
[Synonyms]

(3aS,6aS)-1,3a,4,6a-tetrahydro-3,6-diphenylpentalen
(3aS,6aS)-1,3a,4,6a-tetrahydro-3,6-diphenylpentalene
(3aS,6aS)-3,6-Diphenyl-1,3a,4,6a-tetrahydropentalene
(3aS,6aS)-3,6-Diphenyl-1,3a,4,6a-tetrahydropentalene 97%
Pentalene, 1,3a,4,6a-tetrahydro-3,6-diphenyl-, (3aS,6aS)-
[Molecular Formula]

C20H18
[MDL Number]

MFCD11045471
[MOL File]

940280-80-8.mol
[Molecular Weight]

258.36
Chemical PropertiesBack Directory
[Melting point ]

104-109 °C
[Boiling point ]

415.5±45.0 °C(Predicted)
[density ]

1.104±0.06 g/cm3(Predicted)
[storage temp. ]

2-8°C
[form ]

powder
[Optical Rotation]

[α]22/D +451, c =1 in chloroform
[InChI]

1S/C20H18/c1-3-7-15(8-4-1)17-11-13-20-18(12-14-19(17)20)16-9-5-2-6-10-16/h1-12,19-20H,13-14H2/t19-,20-/m1/s1
[InChIKey]

IEWYLVULSUMUEM-WOJBJXKFSA-N
[SMILES]

C1C=C([C@H]2CC=C([C@@H]12)c3ccccc3)c4ccccc4
Safety DataBack Directory
[WGK Germany ]

WGK 3
[Storage Class]

13 - Non Combustible Solids
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