Basic information
- CAS
139474-25-2- Standard SMILES
CN1CCC(O)(c2ccc(Br)cc2)CC1- InChIKey
GQPLQVMAOCKIHC-UHFFFAOYSA-N- Molecular formula
- C12H16BrNO
- Average molar mass
- 270.17 g/mol
- Monoisotopic mass
- 269.04152623
Names & identifiers
- Preferred name
- 4-(4-Bromophenyl)-1-methylpiperidin-4-ol
- IUPAC
- 4-(4-bromophenyl)-1-methylpiperidin-4-ol
- English name
- 4-(4-BROMO-PHENYL)-1-METHYL-PIPERIDIN-4-OL
- Molecular formula
- C12H16BrNO
- Molecular weight
- 270.17
Names & synonyms
139474-25-24-(4-bromophenyl)-1-methylpiperidin-4-ol4-Piperidinol, 4-(4-bromophenyl)-1-methyl-1-Methyl-4-(4-bromophenyl)-4-piperidinol4-(4-BROMO-PHENYL)-1-METHYL-PIPERIDIN-4-OL4-(4-bromophenyl)-1-methyl-4-Piperidinol4-(4-bromophenyl)-1-methyl-piperidin-4-olSCHEMBL578244DTXSID10443186GQPLQVMAOCKIHC-UHFFFAOYSA-NPFA47425MFCD15523831
Show more names
4-(4-bromophenyl)-1-methylpiperidin-4-ol - [AC77801]
4(4-bromophenyl)-1-methylpiperidin-4-olBS-21390DB-366833EN300-319838F80422
Database identifiers
- CAS
139474-25-2- PubChem CID
- 10659634
- DTXSID
DTXSID10443186
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 206
Physicochemical properties
- Boiling point
- 368.4 · 368.4±42.0 °C(Predicted)
- Density
- 1.397 · 1.397±0.06 g/cm3(Predicted)
- pka
- 13.86 · 13.86±0.20(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers9 total
安徽合诺生物科技有限公司0555-2761852
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
成都安米诺泰医药科技有限公司028-85755578 18140172005 · [email protected]
上海安米克化学品有限公司微信 17321281695 18019252918 · [email protected]
吉林中科研伸科技有限公司18143011203 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]
河北药成医药科技有限责任公司19903117580 19903117510 · [email protected]
Related reactions
13 records
Compound notes
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