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4-PHENOXYBENZONITRILE

4-PHENOXYBENZONITRILE structure

CAS No:
3096-81-9
Formula:
C13H9NO
Chemical Name:
4-PHENOXYBENZONITRILE
Synonyms:
4-PHENOXYBENZONITRILE;4-CYANODIPHENYLETHER;Benzonitrile,4-phenoxy-;4-PHENOXYBENZENECARBONITRILE
Categories:
Organic Chemistry > Coordination Complexes

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Description

White crystalline powder

4-PHENOXYBENZONITRILE Basic Attributes

Molecular Weight：

195.221

Exact Mass：

195.068420

DSSTox ID：

DTXSID90184949

HScode：

2926909090

Characteristics

PSA：

XLogP3：

3.99

Density：

1.2±0.1 g/cm3

Melting Point：

42-46 °C(lit.)

Boiling Point：

325.4±25.0 °C at 760 mmHg

Flash Point：

137.3±17.0 °C

Refractive Index：

1.610

Safety Information

Packing level：

III

Hazard category：

6.1

Transport codes：

3439

wgk germany：

hazard class code：

R20/21/22

safety instructions：

S26-S36

Marks：

Xn: Harmful;

Precautionary statement(s)：

P280

Hazard Statements：

H302-H312-H332

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|Aggregated GHS information provided by 46 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:195.22
XLogP3:3.4
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:195.068413911
Monoisotopic Mass:195.068413911
Topological Polar Surface Area:33
Heavy Atom Count:15
Complexity:228
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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4-Phenoxybenzonitrile 99% kanbei

CAS No.: 3096-81-9

Content: 99%

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