2-Methylhex-1-en-5-yn-3-ol
Basic information
- CAS
88376-85-6- Standard SMILES
C#CCC(O)C(=C)C- InChIKey
XGEZBKXOWDBKEQ-UHFFFAOYSA-N- Molecular formula
- C7H10O
- Average molar mass
- 110.15 g/mol
- Monoisotopic mass
- 110.07316494
Names & identifiers
- Preferred name
- 2-Methylhex-1-en-5-yn-3-ol
- IUPAC
- 2-methylhex-1-en-5-yn-3-ol
Names & synonyms
2-Methylhex-1-en-5-yn-3-ol88376-85-6SCHEMBL23783559DTXSID40541008
Database identifiers
- CAS
88376-85-6- PubChem CID
- 13443333
- DTXSID
DTXSID40541008
Properties
Computed structural properties
- XLogP
- 1.4
- 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
- 127
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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