2-Methyl-4-hexen-3-ol
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Basic information
- CAS
4798-60-1- Standard SMILES
CC=CC(O)C(C)C- InChIKey
WFRYPJOHULJNDS-UHFFFAOYSA-N- Molecular formula
- C7H14O
- Average molar mass
- 114.19 g/mol
- Monoisotopic mass
- 114.10446507
Names & identifiers
- Preferred name
- 2-Methyl-4-hexen-3-ol
- IUPAC
- 2-methylhex-4-en-3-ol
Names & synonyms
2-Methyl-4-hexen-3-olPropenylisopropylcarbinolSCHEMBL5155883SCHEMBL84187802-METHYLHEX-4-EN-3-OLWFRYPJOHULJNDS-UHFFFAOYSA-NDTXSID1013146294798-60-1
Database identifiers
- CAS
4798-60-1- PubChem CID
- 145295
- DTXSID
DTXSID101314629
Properties
Computed structural propertiesFilling in
- XLogP
- 1.8
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 74
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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