Phenyl-piperidin-4-yl-methanol

HCID 339086

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 38081-60-6
Standard SMILES: OC(c1ccccc1)C1CCNCC1
InChIKey: DUZLYYVHAOTWSF-UHFFFAOYSA-N
Molecular formula: C12H17NO
Average molar mass: 191.27 g/mol
Monoisotopic mass: 191.13101416

Names & identifiers

Preferred name: Phenyl-piperidin-4-yl-methanol
IUPAC: phenyl(piperidin-4-yl)methanol
English name: Phenyl-piperidin-4-yl-methanol
Molecular formula: C12H17NO
Molecular weight: 191.27

Names & synonyms

Phenyl-piperidin-4-yl-methanolRefChem:861686820-433-6phenyl(piperidin-4-yl)methanol38081-60-6Phenylpiperidin-4-ylmethanolMFCD05864581a-Phenyl-4-piperidinemethanolphenyl(4-piperidinyl)methanolphenyl(4-piperidyl)methanol4-Piperidinemethanol, |A-phenyl-phenyl-4-piperidylmethan-1-ol

Show more names

α-Phenyl-4-piperidinemethanola-Phenyl-4-piperidinemethanol]4-Piperidinemethanol, α-phenyl-a-Phenyl-4-piperidinemethanol HClphenyl(piperidin-4-yl)methanol(SALTDATA: FREE)

orb3026156SCHEMBL1405681SCHEMBL4676513phenyl-piperidine-4-yl-methanolCHEMBL4552066phenyl (piperidin-4-yl)methanolSCHEMBL280004634-(hydroxyphenylmethyl)piperidine

Database identifiers

CAS: 38081-60-6
PubChem CID: 339086
DTXSID: DTXSID70320762
ChEMBL: CHEMBL4552066
EC Number: 820-433-6
Nikkaji: J3.289.953F

Properties

Computed structural properties

XLogP: 1.4
Topological polar surface area: 32.3 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 2
Rotatable bonds: 2
Heavy atoms: 14
Formal charge: 0
Complexity: 160

Physicochemical properties

Melting point: 166 · 166-167 °C
Boiling point: 332 · 332.0±22.0 °C(Predicted)
Density: 1.068 · 1.068±0.06 g/cm3(Predicted)
storage temp.: Store at Room Tem.
pka: 14.13 · 14.13±0.20(Predicted)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 261 · P261-P305+P351+P338
Hazard Codes: Xi
Risk Statements: 36 · 36
Safety Statements: 26 · 26
HS Code: 2933399990 · 2933399990

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.