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Structure

2,1,3-Benzothiadiazol-5-yl isothiocyanate

CAS
337508-62-0
Catalog Number
ACM337508620
Category
Other Products
Molecular Weight
193.25
Molecular Formula
C7H3N3S2

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Specification

Synonyms
2,1,3-BENZOTHIADIAZOL-5-YL ISOTHIOCYANATE;BUTTPARK 95\50-69;1,2,3-Benzothiadiazol-5-ylisothiocyanate;5-Isothiocyanato-2,1,3-benzothiadiazole;2,1,3-Benzothiadiazole,5-isothiocyanato-(9CI)
IUPAC Name
5-isothiocyanato-2,1,3-benzothiadiazole
Canonical SMILES
C1=CC2=NSN=C2C=C1N=C=S
InChI Key
HHDWFDQYUFKNCO-UHFFFAOYSA-N
Boiling Point
332.6ºC at 760 mmHg
Melting Point
96ºC
Flash Point
155ºC
Density
1.54g/cm³
Exact Mass
192.97700
Hazard Statements
Xn:Harmful;
H-Bond Acceptor
5
H-Bond Donor
0
Safety Description
S26-S36/37/39
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