2,5-Dimethyloctahydropentalene
Basic information
- CAS
28588-55-8- Standard SMILES
CC1CC2CC(C)CC2C1- InChIKey
SQRZZYQFRGXZID-UHFFFAOYSA-N- Molecular formula
- C10H18
- Average molar mass
- 138.25 g/mol
- Monoisotopic mass
- 138.14085057
Names & identifiers
- Preferred name
- 2,5-Dimethyloctahydropentalene
- IUPAC
- 2,5-dimethyl-1,2,3,3a,4,5,6,6a-octahydropentalene
- English name
- Octahydro-2,5-dimethylpentalene
- Molecular weight
- 0
Names & synonyms
28588-55-82,5-DimethyloctahydropentalenePentalene, octahydro-2,5-dimethyl-SCHEMBL189023982,5-Dimethyloctahydropentalene #DTXSID90339598SQRZZYQFRGXZID-UHFFFAOYSA-N3,7-dimethylbicyclo[3.3.0]octaneOctahydro-2,5-dimethylpentalene
Database identifiers
- CAS
28588-55-8- PubChem CID
- 557191
- DTXSID
DTXSID90339598- Nikkaji
- J101.250I
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 100
Experimental & physicochemical properties
SpringerMaterials PropertiesDensity
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Related reactions
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Compound notes
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