Basic information
- CAS
31889-35-7- Standard SMILES
CCC1(CC)OC(C)C(O)C1O- InChIKey
VLARUIVWYZUTDG-UHFFFAOYSA-N- Molecular formula
- C9H18O3
- Average molar mass
- 174.24 g/mol
- Monoisotopic mass
- 174.12559443
Names & identifiers
- Preferred name
- 3,4-Furandiol, tetrahydro-2,2-diethyl-5-methyl-
- IUPAC
- 2,2-diethyl-5-methyloxolane-3,4-diol
Names & synonyms
31889-35-73,4-FURANDIOL, TETRAHYDRO-2,2-DIETHYL-5-METHYL-RefChem:10658262,2-Diethyl-5-methyltetrahydrofuran-3,4-diol
Database identifiers
- CAS
31889-35-7- PubChem CID
- 35968
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 49.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 154
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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