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4-Benzyl-1,2,5-Thiadiazol-3-Ol
[CAS# 5933-69-7]

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Identification
Name 4-Benzyl-1,2,5-Thiadiazol-3-Ol
Synonyms Ethyl 2-[3-[(E)-(2-Amino-4-Oxo-Thiazol-5-Ylidene)Methyl]-2,5-Dimethyl-Pyrrol-1-Yl]-4,5,6,7-Tetrahydrobenzothiophene-3-Carboxylate; 2-[3-[(E)-(2-Amino-4-Oxo-5-Thiazolylidene)Methyl]-2,5-Dimethyl-1-Pyrrolyl]-4,5,6,7-Tetrahydrobenzothiophene-3-Carboxylic Acid Ethyl Ester; 2-[3-[(E)-(2-Amino-4-Keto-Thiazol-5-Ylidene)Methyl]-2,5-Dimethyl-Pyrrol-1-Yl]-4,5,6,7-Tetrahydrobenzothiophene-3-Carboxylic Acid Ethyl Ester
Molecular Structure CAS#: 5933-69-7, 4-Benzyl-1,2,5-Thiadiazol-3-Ol
Molecular Formula C21H23N3O3S2
Molecular Weight 429.55
CAS Registry Number 5933-69-7
SMILES C3=C([N](C1=C(C2=C(S1)CCCC2)C(OCC)=O)C(=C3\C=C/4SC(=NC4=O)N)C)C
InChI 1S/C21H23N3O3S2/c1-4-27-20(26)17-14-7-5-6-8-15(14)28-19(17)24-11(2)9-13(12(24)3)10-16-18(25)23-21(22)29-16/h9-10H,4-8H2,1-3H3,(H2,22,23,25)/b16-10+
InChIKey BUTMTNCGEBPQGU-MHWRWJLKSA-N
Properties
Density 1.45g/cm3 (Cal.)
Boiling point 672.885°C at 760 mmHg (Cal.)
Flash point 360.748°C (Cal.)
Safety Data
SDS Available
Market Analysis Reports
List of Reports Available for 4-Benzyl-1,2,5-Thiadiazol-3-Ol
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