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3-acetyl-2,6-dichloro-5-fluoro-benzonitrile

3-acetyl-2,6-dichloro-5-fluoro-benzonitrile structure

CAS No:
466639-57-6
Formula:
C9H4Cl2FNO
Chemical Name:
3-acetyl-2,6-dichloro-5-fluoro-benzonitrile
Synonyms:
3-Acetyl-2,6-dichloro-5-fluorobenzonitrile;3-ACETYL-2,6-DICHLORO-5-FLUORO-BENZONITRILE;SCHEMBL5704378;CTK1D4913;DTXSID40697251;ZINC90562670;FT-0698439;Benzonitrile, 3-acetyl-2,6-dichloro-5-fluoro-

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3-acetyl-2,6-dichloro-5-fluoro-benzonitrile Basic Attributes

Molecular Weight：

232.0385632

Exact Mass：

230.96500

DSSTox ID：

DTXSID40697251

Characteristics

PSA：

40.9

XLogP3：

3.20678

Density：

1.47g/cm3

Boiling Point：

339.7ºC at 760 mmHg

Flash Point：

159.2ºC

Refractive Index：

1.556

Computed Properties

Molecular Weight:232.03
XLogP3:2.7
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:230.9653973
Monoisotopic Mass:230.9653973
Topological Polar Surface Area:40.9
Heavy Atom Count:14
Complexity:288
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-acetyl-2,6-dichloro-5-fluoro-benzonitrile

Basic Attributes
Characteristics
Computed Properties

3-acetyl-2,6-dichloro-5-fluoro-benzonitrile

SDS

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