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5-(1-Benzothiophen-3-yl)-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione

HCID 3728126
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Basic information

CAS
588687-45-0
Standard SMILES
Cn1c(-c2csc3ccccc23)n[nH]c1=S
InChIKey
HYAGAYJNXSBVSP-UHFFFAOYSA-N
Molecular formula
C11H9N3S2
Average molar mass
247.348 g/mol
Monoisotopic mass
247.02378929

Names & identifiers

Preferred name
5-(1-Benzothiophen-3-yl)-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
IUPAC
5-(1-Benzothiophen-3-yl)-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
English name
3H-1,2,4-Triazole-3-thione,5-benzo[b]thien-3-yl-2,4-dihydro-4-methyl-(9CI)
Molecular formula
C11H9N3S2
Molecular weight
247.34

Names & synonyms

IVK/1266319Albb-0032015-(3-benzothiophenyl)-4-methyl-2H-1,2,4-triazole-3-thione5-(benzothiophen-3-yl)-4-methyl-2H-1,2,4-triazole-3-thione5-(1-benzothiophen-3-yl)-4-methyl-2H-1,2,4-triazole-3-thione5-(Benzo[b]thiophen-3-yl)-4-methyl-4H-1,2,4-triazole-3-thiol3H-1,2,4-Triazole-3-thione, 5-benzo[b]thien-3-yl-2,4-dihydro-4-methyl-5-(1-benzothien-3-yl)-4-methyl-4H-1,2,4-triazole-3-thiol(SALTDATA: FREE)3H-1,2,4-Triazole-3-thione,5-benzo[b]thien-3-yl-2,4-dihydro-4-methyl-(9CI)

Database identifiers

CAS
588687-45-0
PubChem CID
3728126
DTXSID
DTXSID60395606

Properties

Physicochemical properties

Boiling point
375.8 · 375.8±34.0 °C(Predicted)
Density
1.48 · 1.48±0.1 g/cm3(Predicted)
pka
8.75 · 8.75±0.20(Predicted)

Chemistry & industry

Suppliers2 total

北京百灵威科技有限公司18210857532 18210857532 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes