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5-Benzothiazolecarbonitrile,2-(methylthio)-(9CI)

5-Benzothiazolecarbonitrile,2-(methylthio)-(9CI) structure

CAS No:
401567-16-6
Formula:
C9H6N2S2
Chemical Name:
5-Benzothiazolecarbonitrile,2-(methylthio)-(9CI)
Synonyms:
SCHEMBL1747932;ZINC45236065;2-methylsulfanylbenzothiazole-5-carbonitrile;5-benzothiazolecarbonitrile,2-(methylthio)-;2-methylsulfanylbenzothiazole-5-carbo-nitrile;5-Benzothiazolecarbonitrile, 2-(methylthio)-;2-methylsulfanyl-1,3-benzothiazole-5-carbonitrile

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5-Benzothiazolecarbonitrile,2-(methylthio)-(9CI) Basic Attributes

Molecular Weight：

206.28734

Exact Mass：

205.997

Characteristics

PSA：

90.2

XLogP3：

2.8

Computed Properties

Molecular Weight:206.3
XLogP3:2.8
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:205.99724055
Monoisotopic Mass:205.99724055
Topological Polar Surface Area:90.2
Heavy Atom Count:13
Complexity:235
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-Benzothiazolecarbonitrile,2-(methylthio)-(9CI)

Basic Attributes
Characteristics
Computed Properties

5-Benzothiazolecarbonitrile,2-(methylthio)-(9CI)

SDS

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