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4-[(3-Methylphenyl)amino]-1-(phenylmethyl)-4-piperidinecarbonitrile

4-[(3-Methylphenyl)amino]-1-(phenylmethyl)-4-piperidinecarbonitrile structure

CAS No:
972-18-9
Formula:
C20H23N3
Chemical Name:
4-[(3-Methylphenyl)amino]-1-(phenylmethyl)-4-piperidinecarbonitrile
Synonyms:
4-Piperidinecarbonitrile,4-[(3-methylphenyl)amino]-1-(phenylmethyl)-;Isonipecotonitrile,1-benzyl-4-m-toluidino-;4-[(3-Methylphenyl)amino]-1-(phenylmethyl)-4-piperidinecarbonitrile;ST 38624;NSC 73009

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4-[(3-Methylphenyl)amino]-1-(phenylmethyl)-4-piperidinecarbonitrile Basic Attributes

Molecular Weight：

305.41672

Exact Mass：

305.42

EC Number：

213-543-5

NSC Number：

73009

DSSTox ID：

DTXSID90242770

HScode：

2933399090

Characteristics

PSA：

39.1

XLogP3：

3.9

Density：

1.13g/cm3

Melting Point：

95.5-97.0 °C

Boiling Point：

484.4ºC at 760 mmHg

Flash Point：

246.7ºC

Refractive Index：

1.612

Safety Information

Precautionary statement(s)：

P264, P273, P280, P305+P351+P338, P337+P313, P391, P501

Hazard Statements：

H319

GHS Classification：

|Warning|H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]|P264, P273, P280, P305+P351+P338, P337+P313, P391, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:305.4
XLogP3:3.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:305.189197746
Monoisotopic Mass:305.189197746
Topological Polar Surface Area:39.1
Heavy Atom Count:23
Complexity:410
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-[(3-Methylphenyl)amino]-1-(phenylmethyl)-4-piperidinecarbonitrile

Basic Attributes
Characteristics
Safety Information
Computed Properties

4-[(3-Methylphenyl)amino]-1-(phenylmethyl)-4-piperidinecarbonitrile

SDS

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