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Structure

4-Methyl-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazole-3-thiol

CAS
77803-41-9
Catalog Number
ACM77803419
Category
Other Products
Molecular Weight
281.330800 [g/mol]
Molecular Formula
C12H15N3O3S

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Specification

Synonyms
Oprea1_531443, MolPort-000-871-332, MolPort-002-028-464, STK441378, HMS1701M03, ALBB-003282, CID898204, HTS 13402, ZINC00476074, ZINC02518741, BAS 15425037, 4-methyl-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazole-3-thiol, 4-Methyl-5-(3,4,5-trimethoxy-phenyl)-2,4-dihydro-[1,2,4]triazole-3-thione, 77803-41-9
IUPAC Name
4-methyl-3-(3,4,5-trimethoxyphenyl)-1H-1,2,4-triazole-5-thione
Canonical SMILES
CN1C(=NNC1=S)C2=CC(=C(C(=C2)OC)OC)OC
InChI Key
KZMMIESIWSAKOO-UHFFFAOYSA-N
Boiling Point
377.2ºC at 760 mmHg
Flash Point
181.9ºC
Density
1.31g/cm³
Exact Mass
281.08300
Hazard Statements
Xi: Irritant;
H-Bond Acceptor
4
H-Bond Donor
1
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