Basic information
- CAS
20536-87-2- Standard SMILES
CCC(C)(O)C#CCN(C)C- InChIKey
ZQJRTSLDZPYDPS-UHFFFAOYSA-N- Molecular formula
- C9H17NO
- Average molar mass
- 155.24 g/mol
- Monoisotopic mass
- 155.13101417
Names & identifiers
- Preferred name
- 6-(Dimethylamino)-3-methylhex-4-yn-3-ol
- IUPAC
- 6-(dimethylamino)-3-methylhex-4-yn-3-ol
Names & synonyms
6-(dimethylamino)-3-methylhex-4-yn-3-ol20536-87-26-(Dimethylamino)-3-methyl-4-hexyn-3-ol4-Hexyn-3-ol ,6-(dimethylamino)-3-methyl-DTXSID50942709
Database identifiers
- CAS
20536-87-2- PubChem CID
- 177136
- DTXSID
DTXSID50942709
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 174
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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