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Structure

5-Benzothiazolecarbonitrile

CAS
58249-57-3
Catalog Number
ACM58249573
Category
Other Products
Molecular Weight
160.2
Molecular Formula
C8H4N2S

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Specification

Synonyms
5-BENZOTHIAZOLECARBONITRILE;5-Benzothiazolecarbonitrile(7CI,9CI)
IUPAC Name
1,3-benzothiazole-5-carbonitrile
Canonical SMILES
C1=CC2=C(C=C1C#N)N=CS2
InChI Key
KZWJUNXNZGVOOS-UHFFFAOYSA-N
Boiling Point
321.422ºC at 760 mmHg
Flash Point
148.191ºC
Density
1.366g/cm³
Exact Mass
160.01000
H-Bond Acceptor
3
H-Bond Donor
0
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