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5-Methyl-2-benzothiazoleacetonitrile

5-Methyl-2-benzothiazoleacetonitrile structure

CAS No:
157764-08-4
Formula:
C10H8N2S
Chemical Name:
5-Methyl-2-benzothiazoleacetonitrile
Synonyms:
2-Benzothiazoleacetonitrile,5-methyl-;5-Methyl-2-benzothiazoleacetonitrile;2-(5-Methyl-1,3-benzothiazol-2-yl)acetonitrile;2-(5-Methylbenzo[d]thiazol-2-yl)acetonitrile

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5-Methyl-2-benzothiazoleacetonitrile Basic Attributes

Molecular Weight：

188.248

Exact Mass：

188.25

Characteristics

PSA：

64.9

XLogP3：

2.4

Density：

1.265±0.06 g/cm3(Predicted)

Boiling Point：

345.1±25.0 °C(Predicted)

Computed Properties

Molecular Weight:188.25
XLogP3:2.4
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:188.04081944
Monoisotopic Mass:188.04081944
Topological Polar Surface Area:64.9
Heavy Atom Count:13
Complexity:232
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-Methyl-2-benzothiazoleacetonitrile

Basic Attributes
Characteristics
Computed Properties

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