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2-Benzothiazolebutyronitrile(8CI)

2-Benzothiazolebutyronitrile(8CI) structure

CAS No:
21344-52-5
Formula:
C11H10N2S
Chemical Name:
2-Benzothiazolebutyronitrile(8CI)
Synonyms:
4-(benzo[d]thiazol-2-yl)butanenitrile;2-benzothiazolebutyronitrile;CTK4E6549;DTXSID80663359;ZINC45237945;2-BENZO[D]THIAZOLEBUTANENITRILE;4-(1,3-benzothiazol-2-yl)butanenitrile

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2-Benzothiazolebutyronitrile(8CI) Basic Attributes

Molecular Weight：

202.275

Exact Mass：

202.056

DSSTox ID：

DTXSID80663359

Characteristics

PSA：

64.9

XLogP3：

2.9

Density：

1.222±0.06 g/cm3(Predicted)

Computed Properties

Molecular Weight:202.28
XLogP3:2.9
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:202.05646950
Monoisotopic Mass:202.05646950
Topological Polar Surface Area:64.9
Heavy Atom Count:14
Complexity:233
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-Benzothiazolebutyronitrile(8CI)

Basic Attributes
Characteristics
Computed Properties

2-Benzothiazolebutyronitrile(8CI)

SDS

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