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4-(DIFLUOROMETHOXY)BENZONITRILE

4-(DIFLUOROMETHOXY)BENZONITRILE structure

CAS No:
90446-25-6
Formula:
C8H5F2NO
Chemical Name:
4-(DIFLUOROMETHOXY)BENZONITRILE
Synonyms:
AKOS B018635;ART-CHEM-BB B018635;4-(DIFLUOROMETHOXY)BENZONITRILE;4-(Difluoromethoxy)benzonitrile98%;4-(Difluoromethoxy)benzonitrile 98%;4-Cyano-alpha,alpha-difluoroanisole, 4-Cyanophenyl difluoromethyl ether
Categories:
Organic Chemistry > Organic Fluorine Compound

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4-(DIFLUOROMETHOXY)BENZONITRILE Basic Attributes

Molecular Weight：

169.13

Exact Mass：

169.03400

HScode：

2926909090

Characteristics

PSA：

XLogP3：

2.6

Density：

1.26g/cm3

Melting Point：

40-42

Boiling Point：

245℃

Flash Point：

102℃

Refractive Index：

1.478

Safety Information

Packing level：

Ⅲ

Hazard category：

TOXIC

Transport codes：

UN 3439 6.1/PG III

hazard class code：

6.1

Marks：

Hazard note：

Toxic

Precautionary statement(s)：

P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P311, P312, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P403+P233, P405, P501

Hazard Statements：

H301+H311+H331

GHS Classification：

|Danger|H301+H311+H331 (50%): Toxic if swallowed, in contact with skin or if inhaled [Danger Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]|P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P311, P312, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:169.13
XLogP3:2.6
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:169.03392011
Monoisotopic Mass:169.03392011
Topological Polar Surface Area:33
Heavy Atom Count:12
Complexity:179
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-(DIFLUOROMETHOXY)BENZONITRILE

Basic Attributes
Characteristics
Safety Information
Computed Properties
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4-(DIFLUOROMETHOXY)BENZONITRILE

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