Basic information
- CAS
1146080-10-5- Standard SMILES
CC(c1ccc(F)cc1)N1CCC(O)CC1- InChIKey
DTPQDUOJWMJUKR-UHFFFAOYSA-N- Molecular formula
- C13H18FNO
- Average molar mass
- 223.29 g/mol
- Monoisotopic mass
- 223.13724242
Names & identifiers
- Preferred name
- 1-(1-(4-Fluorophenyl)ethyl)piperidin-4-ol
- IUPAC
- 1-[1-(4-fluorophenyl)ethyl]piperidin-4-ol
- English name
- 1-[1-(4-Fluoro-phenyl)-ethyl]-piperidin-4-ol, 98+% C13H18FNO, MW: 223.29
- Molecular formula
- C13H18FNO
- Molecular weight
- 223.29
Names & synonyms
1146080-10-51-[1-(4-Fluoro-phenyl)-ethyl]-piperidin-4-ol1-(1-(4-Fluorophenyl)ethyl)piperidin-4-ol1-[1-(4-fluorophenyl)ethyl]piperidin-4-olSCHEMBL28880055DTXSID50591135SBB074683AKOS0159415291-[(4-fluorophenyl)ethyl]piperidin-4-olDB-2911821-[1-(4-Fluoro-phenyl)-ethyl ]-piperidin-4-ol1-[1-(4-Fluorophenyl)ethyl]-4-piperidinol
Show more names
4-Piperidinol, 1-[1-(4-fluorophenyl)ethyl]-1-[1-(4-Fluoro-phenyl)-ethyl]-piperidin-4-ol, 98+% C13H18FNO, MW: 223.29
Database identifiers
- CAS
1146080-10-5- PubChem CID
- 17823752
- DTXSID
DTXSID50591135
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 208
Physicochemical properties
- Boiling point
- 323.4 · 323.4±27.0 °C(Predicted)
- Density
- 1.149 · 1.149
- pka
- 14.84 · 14.84±0.20(Predicted)
Chemistry & industry
Suppliers3 total
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
江阴安博生物医药有限公司086-010-62176588 · [email protected]
重庆卡兰医药有限公司[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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