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4-CYANO-4-(2-FLUOROPHENYL)CYCLOHEXANONE

4-CYANO-4-(2-FLUOROPHENYL)CYCLOHEXANONE structure

CAS No:
179064-61-0
Formula:
C13H12FNO
Chemical Name:
4-CYANO-4-(2-FLUOROPHENYL)CYCLOHEXANONE
Synonyms:
4-CYANO-4-(2-FLUOROPHENYL)CYCLOHEXANONE;4-Cyano-4-(2-fluorophenyl)cyclohexan-1-one;1-(2-Fluorophenyl)-4-oxocyclohexanecarbonitrile;1-(2-Fluorophenyl)-4-oxocyclohexane-1-carbonitrile

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4-CYANO-4-(2-FLUOROPHENYL)CYCLOHEXANONE Basic Attributes

Molecular Weight：

217.242

Exact Mass：

217.09

DSSTox ID：

DTXSID70618631

Characteristics

PSA：

40.9

XLogP3：

1.7

Safety Information

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:217.24
XLogP3:1.7
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:217.090292168
Monoisotopic Mass:217.090292168
Topological Polar Surface Area:40.9
Heavy Atom Count:16
Complexity:320
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-CYANO-4-(2-FLUOROPHENYL)CYCLOHEXANONE

Basic Attributes
Characteristics
Safety Information
Computed Properties

4-CYANO-4-(2-FLUOROPHENYL)CYCLOHEXANONE

SDS

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