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2,5-Dimercapto-1,3,4-thiadiazole

Catalog Number ACM1072715
CAS 1072-71-5
Structure 2,5-Dimercapto-1,3,4-thiadiazole
Synonyms Bismuthiol I
IUPAC Name 1,3,4-thiadiazolidine-2,5-dithione
Molecular Weight 150.3
Molecular Formula C2H2N2S3
Canonical SMILES C1(=S)NNC(=S)S1
InChI InChI=1S/C2H2N2S3/c5-1-3-4-2(6)7-1/h(H,3,5)(H,4,6)
InChI Key BIGYLAKFCGVRAN-UHFFFAOYSA-N
Boiling Point 211.3±23.0 °C
Melting Point 162 °C
Purity 99%+
Appearance Crystalline powder
Storage Store below +30 °C
Exact Mass 149.93801159
Hydrogen-Bond Acceptor Count 3
Hydrogen-Bond Donor Count 2
Monoisotopic Mass 149.93801159
Rotatable-Bond Count 0
Topological Polar Surface Area 114 Ų
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