CAS 142001-84-1 4-(4-Hydroxyphenyl)piperidin-4-ol (HCID 11063281)

Substructure search Find similar structures

Basic information

CAS: 142001-84-1
Standard SMILES: Oc1ccc(C2(O)CCNCC2)cc1
InChIKey: ZIYRFSOIBBGGDC-UHFFFAOYSA-N
Molecular formula: C11H15NO2
Average molar mass: 193.24 g/mol
Monoisotopic mass: 193.11027872

Names & identifiers

Preferred name: 4-(4-Hydroxyphenyl)piperidin-4-ol
IUPAC: 4-(4-hydroxyphenyl)piperidin-4-ol
English name: 4-(4-Hydroxyphenyl)-4-piperidinol
Molecular formula: C11H15NO2
Molecular weight: 193.24

Names & synonyms

142001-84-14-(4-HYDROXYPHENYL)-4-PIPERIDINOL4-(4-hydroxyphenyl)piperidin-4-olMFCD11849877SCHEMBL652586DTXSID90453824ZIYRFSOIBBGGDC-UHFFFAOYSA-NDB-294741F80311F9816404-Piperidinol, 4-(4-hydroxyphenyl)-

Database identifiers

CAS: 142001-84-1
PubChem CID: 11063281
DTXSID: DTXSID90453824

Properties

Computed structural properties

XLogP: 0.6
Topological polar surface area: 52.5 Å²
Hydrogen bond donors: 3
Hydrogen bond acceptors: 3
Rotatable bonds: 1
Heavy atoms: 14
Formal charge: 0
Complexity: 182

Physicochemical properties

Melting point: 226 · 226-228 °C (decomp)
Boiling point: 380.6 · 380.6±42.0 °C(Predicted)
Density: 1.203 · 1.203±0.06 g/cm3(Predicted)
storage temp.: Store at Room Tem.
pka: 10.15 · 10.15±0.30(Predicted)
Appearance: white solid
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H335
Precautionary statements: 264 · P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501

Safety & regulation

Safety data

Signal word: Warning
Symbol(GHS): GHS07
Hazard statements: H315-H319-H335
Precautionary statements: P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501