Basic information
- CAS
38585-87-4- Standard SMILES
C=C(C)C(O)CO- InChIKey
HBHXLSPUXXXICF-UHFFFAOYSA-N- Molecular formula
- C5H10O2
- Average molar mass
- 102.13 g/mol
- Monoisotopic mass
- 102.06807956
Names & identifiers
- Preferred name
- 3-Methylbut-3-ene-1,2-diol
- IUPAC
- 3-methylbut-3-ene-1,2-diol
Names & synonyms
3-methylbut-3-ene-1,2-diol38585-87-43-Methyl-3-butene-1,2-diol3-Butene-1,2-diol, 3-methyl-SCHEMBL35863SCHEMBL28805124DTXSID30959451EN300-1865458
Database identifiers
- CAS
38585-87-4- PubChem CID
- 181583
- DTXSID
DTXSID30959451- Nikkaji
- J603.774G
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 68.5
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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