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Benzo[b]thiophene-4-carbonitrile

Benzo[b]thiophene-4-carbonitrile structure

CAS No:
17347-34-1
Formula:
C9H5NS
Chemical Name:
Benzo[b]thiophene-4-carbonitrile
Synonyms:
Benzo[b]thiophene-4-carbonitrile;4-Cyanobenzothiophene;1-Benzothiophene-4-carbonitrile

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Benzo[b]thiophene-4-carbonitrile Basic Attributes

Molecular Weight：

159.2077

Exact Mass：

159.21

DSSTox ID：

DTXSID90618375

HScode：

2934999090

Characteristics

PSA：

XLogP3：

2.77298

Density：

1.28±0.1 g/cm3(Predicted)

Boiling Point：

312.7±15.0 °C(Predicted)

Computed Properties

Molecular Weight:159.21
XLogP3:2.7
Hydrogen Bond Acceptor Count:2
Exact Mass:159.01427034
Monoisotopic Mass:159.01427034
Topological Polar Surface Area:52
Heavy Atom Count:11
Complexity:193
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Benzo[b]thiophene-4-carbonitrile

Basic Attributes
Characteristics
Computed Properties

Benzo[b]thiophene-4-carbonitrile

SDS

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