2-Benzylpiperidine supplier | CasNO.32838-55-4

Name
2-BENZYLPIPERIDINE
EINECS 251-255-1
CAS No. 32838-55-4
Article Data25
CAS DataBase
Density 0.969 g/cm³
Solubility
Melting Point 32°C
Formula C₁₂H₁₇N
Boiling Point 267.5 °C at 760 mmHg
Molecular Weight 175.274
Flash Point 116.129 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Piperidine,2-benzyl- (7CI,8CI);
PSA 12.03000
LogP 2.70000

2-Benzylpiperidine Specification

The Piperidine,2-(phenylmethyl)-, with the CAS registry number 32838-55-4, is also known as Piperidine,2-benzyl- (7CI,8CI). It belongs to the product category of Pharmacetical. Its EINECS registry number is 251-255-1. This chemical's molecular formula is C₁₂H₁₇N and molecular weight is 175.27. What's more, its IUPAC name and systematic name are the same which is called 2-Benzylpiperidine.

Physical properties about Piperidine,2-(phenylmethyl)-: (1)ACD/LogP: 2.97; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.13; (4)ACD/LogD (pH 7.4): -0.06; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 3.24 Å²; (13)Index of Refraction: 1.526; (14)Molar Refractivity: 55.57 cm³; (15)Molar Volume: 180.7 cm³; (16)Surface Tension: 36.4 dyne/cm; (17)Density: 0.969 g/cm³; (18)Flash Point: 116.1 °C; (19)Enthalpy of Vaporization: 50.55 kJ/mol; (20)Boiling Point: 267.5 °C at 760 mmHg; (21)Vapour Pressure: 0.00812 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: c1c(cccc1)CC2NCCCC2
(2) InChI: InChI=1/C12H17N/c1-2-6-11(7-3-1)10-12-8-4-5-9-13-12/h1-3,6-7,12-13H,4-5,8-10H2
(3) InChIKey: ITXCORRITGNIHP-UHFFFAOYAB

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mouse	LD50	subcutaneous	195mg/kg (195mg/kg)	BEHAVIORAL: TREMOR BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD CARDIAC: PULSE RATE INCREASE WITHOUT FALL IN BP	Naunyn-Schmiedeberg's Archiv fuer Experimentelle Pathologie und Pharmakologie. Vol. 227, Pg. 129, 1955.

Product Name

2-BENZYLPIPERIDINE

2-Benzylpiperidine Specification

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