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CAS Number: 37566-39-5
5-bromo-1,3,4-thiadiazol-2-amine

Structure

5-bromo-1,3,4-thiadiazol-2-amine
Name: 5-bromo-1,3,4-thiadiazol-2-amine
Synonyms:
General Information
Product Number: 37566395

CAS Registry Number 37566-39-5
Name:
1,?3,?4-?Thiadiazol-?2-?amine, 5-?bromo-
5-Bromo-1,3,4-thiadiazol-2-amine
(5-Bromo-1,3,4-thiadiazol-2-yl)amine
2-Amino-5-bromo-1,3,4-thiadiazole
2-Amino-5-bromothiadiazole
2-Bromo-5-amino-1,3,4-thiadiazole

 

Chemical Formula: C2H2BrN3S
Exact Mass: 178.92
Molecular Weight: 180.03
m/z: 180.91 (100.0%), 178.92 (98.2%), 182.91 (4.4%), 179.92 (2.1%), 181.92 (2.1%), 181.91 (2.0%), 179.91 (1.9%)

 

InChI:InChI=1S/C2H2BrN3S/c3-1-5-6-2(4)7-1/h(H2,4,6)

InChI Key:GLYQQFBHCFPEEU-UHFFFAOYSA-N

Canonical SMILES:C1(=NN=C(S1)Br)N

 

Thermal Properties Value Condition Note
Melting Point 184-185 °C Solv: ethanol (64-17-5) (2)IC
Melting Point 182-183 °C Solv: ethanol (64-17-5) (3)IC
Melting Point 180-181 °C Solv: methanol (67-56-1); water (7732-18-5) (4)IC

Specification

98%

References
  1. (2) El-Dine, Sh. A. Shams; Acta Chimica Academiae Scientiarum Hungaricae 1975, V84(1), P85-91 CAPLUS
  2. (3) Werber, Giuseppe; Journal of Heterocyclic Chemistry 1977, V14(5), P823-7 CAPLUS
  3. (4) Heindl, J.; European Journal of Medicinal Chemistry 1975, V10(2), P121-4 CAPLUS
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