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4,5-Dichloro-2-methyl-3(2H)-isothiazolone

4,5-Dichloro-2-methyl-3(2H)-isothiazolone structure

CAS No:
26542-23-4
Formula:
C4H3Cl2NOS
Chemical Name:
4,5-Dichloro-2-methyl-3(2H)-isothiazolone
Synonyms:
4,5-Dichloro-2-methyl-3(2H)-isothiazolone;4,5-dichloro-2-methyl-4-isothiazolin-3-one;4,5-DICHLORO-2-METHYLISOTHIAZOLINONE;4,5-Dichloro-2-Methylisothiazol-3-one

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4,5-Dichloro-2-methyl-3(2H)-isothiazolone Basic Attributes

Molecular Weight：

184.034

Exact Mass：

182.931

UNII：

16E68NA30Z

DSSTox ID：

DTXSID50181116

Characteristics

PSA：

45.6

XLogP3：

1.7

Density：

1.66±0.1 g/cm3(Predicted)

Melting Point：

116 °C

Safety Information

Hazard category：

Transport codes：

2922

Drug Information

MeSH Entry Terms：

4,5-dichloro-2-methyl-4-isothiazolin-3-one

4,5-Dichloro-2-methyl-3(2H)-isothiazolone Use and Manufacturing

4,5-Dichloro-2-methylisothiazol-3-one is an methylisothiazolinone derivative and a potential antimicrobial agent for the inhibition of PCAF activity.

Computed Properties

Molecular Weight:184.04
XLogP3:1.7
Hydrogen Bond Acceptor Count:2
Exact Mass:182.9312403
Monoisotopic Mass:182.9312403
Topological Polar Surface Area:45.6
Heavy Atom Count:9
Complexity:191
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4,5-Dichloro-2-methyl-3(2H)-isothiazolone

Basic Attributes
Characteristics
Safety Information
Drug Information
Use and Manufacturing
Computed Properties

4,5-Dichloro-2-methyl-3(2H)-isothiazolone

SDS

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