Basic information
- Standard SMILES
CC1(C)O[C@H]2[C@@H](O)CC[C@H]2O1- InChIKey
PSOOETMCZCWPBV-XVMARJQXSA-N- Molecular formula
- C8H14O3
- Average molar mass
- 158.19 g/mol
- Monoisotopic mass
- 158.0942943
Names & identifiers
- Preferred name
- (3aS,4S,6aR)-2,2-dimethyltetrahydro-3aH-cyclopenta[d][1,3]dioxol-4-ol
- IUPAC
- (3aS,4S,6aR)-2,2-dimethyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]dioxol-4-ol
Names & synonyms
SCHEMBL1969869PSOOETMCZCWPBV-XVMARJQXSA-N(3aS,4S,6aR)-2,2-dimethyltetrahydro-3aH-cyclopenta[d][1,3]dioxol -4-ol(3aS,4S,6aR)-2,2-dimethyltetrahydro-3aH-cyclopenta[d][1,3]dioxol-4-ol
Database identifiers
- PubChem CID
- 58329311
- Nikkaji
- J2.339.779J
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 167
Related reactions
3 records
Compound notes
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