2-Butyn-1-ol, 4-(1-piperidinyl)-
Basic information
- CAS
14733-49-4- Standard SMILES
OCC#CCN1CCCCC1- InChIKey
PBGNSNOQVSMRAU-UHFFFAOYSA-N- Molecular formula
- C9H15NO
- Average molar mass
- 153.22 g/mol
- Monoisotopic mass
- 153.1153641
Names & identifiers
- Preferred name
- 2-Butyn-1-ol, 4-(1-piperidinyl)-
- IUPAC
- 4-piperidin-1-ylbut-2-yn-1-ol
Names & synonyms
14733-49-44-(1-Piperidinyl)-2-butyn-1-ol2-Butyn-1-ol, 4-(1-piperidinyl)-DTXSID30163677RefChem:258106DTXCID70861684-(piperidin-1-yl)but-2-yn-1-olSCHEMBL21191969N-(4-hydroxybut-2-inyl)piperidineAKOS022140928SB42731
Database identifiers
- CAS
14733-49-4- PubChem CID
- 180780
- DTXSID
DTXSID30163677- Nikkaji
- J2.094.306H
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 159
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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