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2-Benzothiazolepentanenitrile

2-Benzothiazolepentanenitrile structure

CAS No:
21344-53-6
Formula:
C12H12N2S
Chemical Name:
2-Benzothiazolepentanenitrile
Synonyms:
2-Benzothiazolepentanenitrile;2-Benzothiazolevaleronitrile

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2-Benzothiazolepentanenitrile Basic Attributes

Molecular Weight：

216.302

Exact Mass：

216.30

DSSTox ID：

DTXSID20663358

Characteristics

PSA：

64.9

XLogP3：

3.3

Density：

1.188±0.06 g/cm3(Predicted)

Computed Properties

Molecular Weight:216.30
XLogP3:3.3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:216.07211956
Monoisotopic Mass:216.07211956
Topological Polar Surface Area:64.9
Heavy Atom Count:15
Complexity:245
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-Benzothiazolepentanenitrile

Basic Attributes
Characteristics
Computed Properties

2-Benzothiazolepentanenitrile

SDS

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