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2-Benzylpiperidine

2-Benzylpiperidine structure

CAS No:
32838-55-4
Formula:
C12H17N
Chemical Name:
2-Benzylpiperidine
Synonyms:
Piperidine,2-(phenylmethyl)-;Piperidine,2-benzyl-;2-(Phenylmethyl)piperidine;2-Benzylpiperidine
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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2-Benzylpiperidine Basic Attributes

Molecular Weight：

175.27

Exact Mass：

175.27

EC Number：

251-255-1

HScode：

2933399090

Characteristics

PSA：

XLogP3：

2.97

Density：

0.9740 g/cm³ @ Temp: 20 °C

Melting Point：

32 °C

Boiling Point：

267.5 °C

Flash Point：

116.1±14.2 °C

Refractive Index：

1.527

Water Solubility：

7.7 [ug/mL]

Safety Information

Hazard category：

IRRITANT

Precautionary statement(s)：

P264, P270, P301+P312, P330, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (97.56%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 41 companies from 3 notifications to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:175.27
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:175.136099547
Monoisotopic Mass:175.136099547
Topological Polar Surface Area:12
Heavy Atom Count:13
Complexity:138
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes