Pentalene, octahydro-1,4-divinyl-
Basic information
- CAS
17572-84-8- Standard SMILES
C=CC1CCC2C(C=C)CCC12- InChIKey
PNRGHGIYEKXBMP-UHFFFAOYSA-N- Molecular formula
- C12H18
- Average molar mass
- 162.27 g/mol
- Monoisotopic mass
- 162.14085057
Names & identifiers
- Preferred name
- Pentalene, octahydro-1,4-divinyl-
- IUPAC
- 1,4-bis(ethenyl)-1,2,3,3a,4,5,6,6a-octahydropentalene
- English name
- Octahydro-1,4-divinylpentalene
- Molecular weight
- 0
Names & synonyms
Pentalene, octahydro-1,4-divinyl-1,4-bis(ethenyl)-1,2,3,3a,4,5,6,6a-octahydropentalene17572-84-81,4-DiethenyloctahydropentaleneSCHEMBL138352571,4-Divinyloctahydropentalene #DTXSID30338388PNRGHGIYEKXBMP-UHFFFAOYSA-NOctahydro-1,4-divinylpentalene
Database identifiers
- CAS
17572-84-8- PubChem CID
- 548858
- DTXSID
DTXSID30338388- Nikkaji
- J113.046C
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 170
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Related reactions
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Compound notes
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