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2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetonitrile

2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetonitrile structure

CAS No:
358624-88-1
Formula:
C9H5N3O2S2
Chemical Name:
2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetonitrile
Synonyms:
C9H5N3O2S2;ZINC1818727;STK742530;AKOS003250922;MCULE-7858061739;358624-88-1;ST51011372;2-(6-nitrobenzothiazol-2-ylthio)ethanenitrile;[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetonitrile

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2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetonitrile Basic Attributes

Molecular Weight：

251.3 g/mol

Exact Mass：

250.98231876 g/mol

Characteristics

PSA：

136 Å²

Computed Properties

Molecular Weight:251.3
XLogP3:3.1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:250.98231876
Monoisotopic Mass:250.98231876
Topological Polar Surface Area:136
Heavy Atom Count:16
Complexity:325
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetonitrile

Basic Attributes
Characteristics
Computed Properties

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