(1-Benzylpiperidin-2-yl)methanol

HCID 2735486

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Basic information

CAS: 85387-43-5
Standard SMILES: OCC1CCCCN1Cc1ccccc1
InChIKey: KHPWHJVKPZIZRG-UHFFFAOYSA-N
Molecular formula: C13H19NO
Average molar mass: 205.3 g/mol

Names & identifiers

Preferred name: (1-Benzylpiperidin-2-yl)methanol
IUPAC: (1-benzylpiperidin-2-yl)methanol
English name: (1-BENZYL-2-PIPERIDINYL)METHANOL
Molecular formula: C13H19NO
Molecular weight: 205.3

Names & synonyms

85387-43-5(1-benzylpiperidin-2-yl)methanolRefChem:392065817-720-31-benzyl-2-piperidinemethanol(1-Benzyl-2-piperidinyl)methanolMFCD00831046209126-90-9(1-Benzyl-piperidin-2-yl)-methanol1-Benzylpiperidine-2-methanol(1-benzyl-2-piperidyl)methanol2-Piperidinemethanol, 1-(phenylmethyl)-

Show more names

BUTTPARK 147\04-141-BENZYL-2-(HYDROXYMETHYL)PIPERIDINE1-Benzyl-2-(hydroxymethyl)piperidine, 1-{[2-(Hydroxymethyl)piperidin-1-yl]methyl}benzene

n-benzylpiperidine-2-methanol1-benzyl-2-piperidine methanolSCHEMBL1051602KHPWHJVKPZIZRG-UHFFFAOYSA-NKDA38743[1-benzyl-2-piperidyl]methan-1-olSBB0935191-benzyl-2-(hydroxymethyl)-piperidine

Database identifiers

CAS: 85387-43-5
PubChem CID: 2735486
EC Number: 817-720-3
Nikkaji: J2.501.130I

Properties

Computed structural properties

XLogP: 2
Topological polar surface area: 23.5 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 3
Heavy atoms: 15
Formal charge: 0
Complexity: 177

Physicochemical properties

Boiling point: 134 · 134/0.15mm
Density: 1.056 · 1.056±0.06 g/cm3(Predicted)
storage temp.: 2 · 2-8°C, protect from light
pka: 15.08 · 15.08±0.10(Predicted)
Appearance: Colorless to light yellow Liquid
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302+H312+H332-H315-H319-H335
Precautionary statements: 280 · P280
Hazard Codes: Xi
HazardClass: IRRITANT
HS Code: 2933399990 · 2933399990

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

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

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.