3-Methyl-4-penten-2-ol
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Basic information
- CAS
1569-59-1- Standard SMILES
C=CC(C)C(C)O- InChIKey
COIPQIFWUIDWLU-UHFFFAOYSA-N- Molecular formula
- C6H12O
- Average molar mass
- 100.16 g/mol
- Monoisotopic mass
- 100.088815
Names & identifiers
- Preferred name
- 3-Methyl-4-penten-2-ol
- IUPAC
- 3-methylpent-4-en-2-ol
- English name
- 3-Methyl-4-penten-2-ol
- Molecular formula
- C6H12O
- Molecular weight
- 100.16
Names & synonyms
3-Methyl-4-penten-2-ol1569-59-14-Penten-2-ol, 3-methyl-RefChem:280912COIPQIFWUIDWLU-UHFFFAOYSA-N3-methylpent-4-en-2-ol(2S,3S)-3-methylpent-4-en-3-olSCHEMBL713747SCHEMBL713748SCHEMBL9448759SCHEMBL28494225DTXSID80870889
Show more names
AKOS006273507rel-(2S,3R)-3-methylpent-4-en-2-olEN300-1624289
Database identifiers
- CAS
1569-59-1- PubChem CID
- 544701
- DTXSID
DTXSID80870889- Nikkaji
- J141.782G
Properties
Computed structural propertiesFilling in
- XLogP
- 1.4
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 59
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Related reactions
1 records
Compound notes
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