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3-[[(2-Chlorophenyl)methyl]sulfonyl]-5-methyl-4-isothiazolecarbonitrile

3-[[(2-Chlorophenyl)methyl]sulfonyl]-5-methyl-4-isothiazolecarbonitrile structure

CAS No:
339021-04-4
Formula:
C12H9ClN2O2S2
Chemical Name:
3-[[(2-Chlorophenyl)methyl]sulfonyl]-5-methyl-4-isothiazolecarbonitrile
Synonyms:
4-Isothiazolecarbonitrile,3-[[(2-chlorophenyl)methyl]sulfonyl]-5-methyl-;3-[[(2-Chlorophenyl)methyl]sulfonyl]-5-methyl-4-isothiazolecarbonitrile;3-((2-Chlorobenzyl)sulfonyl)-5-methylisothiazole-4-carbonitrile

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3-[[(2-Chlorophenyl)methyl]sulfonyl]-5-methyl-4-isothiazolecarbonitrile Basic Attributes

Molecular Weight：

312.8

Exact Mass：

312.80

Characteristics

PSA：

107

XLogP3：

2.8

Computed Properties

Molecular Weight:312.8
XLogP3:2.8
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:311.9793976
Monoisotopic Mass:311.9793976
Topological Polar Surface Area:107
Heavy Atom Count:19
Complexity:468
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-[[(2-Chlorophenyl)methyl]sulfonyl]-5-methyl-4-isothiazolecarbonitrile

Basic Attributes
Characteristics
Computed Properties

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