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1-(4-Methoxyphenyl)cyclopentanecarbonitrile

1-(4-Methoxyphenyl)cyclopentanecarbonitrile structure

CAS No:
1206-15-1
Formula:
C13H15NO
Chemical Name:
1-(4-Methoxyphenyl)cyclopentanecarbonitrile
Synonyms:
Cyclopentanecarbonitrile,1-(4-methoxyphenyl)-;Cyclopentanecarbonitrile,1-(p-methoxyphenyl)-;1-(4-Methoxyphenyl)cyclopentanecarbonitrile;1-(p-Methoxyphenyl)cyclopentanenitrile;NSC 154614;1-(4-Methoxyphenyl)cyclopentane-1-carbonitrile;1-(4-Methoxyphenyl)-1-cyclopentanecarbonitrile

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Description

clear colorless to pale yellow liquid

1-(4-Methoxyphenyl)cyclopentanecarbonitrile Basic Attributes

Molecular Weight：

201.26

Exact Mass：

201.26

EC Number：

214-890-5

NSC Number：

154614

DSSTox ID：

DTXSID30152920

HScode：

29269095

Characteristics

PSA：

33.02000

XLogP3：

3.03058

Density：

1.0862

Boiling Point：

152-153 °C @ Press: 6 Torr

Flash Point：

146.2ºC

Refractive Index：

1.536-1.538

Safety Information

Hazard category：

IRRITANT

hazard class code：

R20/21/22

safety instructions：

36/37/39-26

Marks：

Precautionary statement(s)：

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:201.26
XLogP3:3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:201.115364102
Monoisotopic Mass:201.115364102
Topological Polar Surface Area:33
Heavy Atom Count:15
Complexity:251
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(4-Methoxyphenyl)cyclopentanecarbonitrile

Description
Basic Attributes
Characteristics
Safety Information
Computed Properties

1-(4-Methoxyphenyl)cyclopentanecarbonitrile

SDS

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