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1-benzothiophene-6-carbonitrile

1-benzothiophene-6-carbonitrile structure

CAS No:
154650-81-4
Formula:
C9H5NS
Chemical Name:
1-benzothiophene-6-carbonitrile
Synonyms:
benzo[b]thiophene-6-carbonitrile;1-benzothiophene-6-carbonitrile;6-cyanobenzo[b]thiophene;SCHEMBL506739;Benzo[b]thiophen-6-carbonitrile;CTK0E7793;DTXSID30618374;ZINC71261341;SB14839;AS-60863

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1-benzothiophene-6-carbonitrile Basic Attributes

Molecular Weight：

159.2077

Exact Mass：

159.01400

DSSTox ID：

DTXSID30618374

HScode：

2934999090

Characteristics

PSA：

XLogP3：

2.7

Density：

1.28±0.1 g/cm3(Predicted)

Melting Point：

41.5-42 °C

Boiling Point：

105-106 °C(Press: 0.1 Torr)

Flash Point：

142.889ºC

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

Hot Searches: smz-tmp; diphenylmethanol; magnesium pyrophosphate formula; aluminum phosphate formula; valeraldehyde; butyl acetate

Guide of 1-benzothiophene-6-carbonitrile

Basic Attributes
Characteristics
Computed Properties

1-benzothiophene-6-carbonitrile

SDS

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