5-[(2,6-Dimethylphenoxy)methyl]-4-phenyl-4H-1,2,4-triazole-3-thiol

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CAS
64013-53-2
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Purity
96%
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Catalog Number

ACM64013532

Product Name

5-[(2,6-Dimethylphenoxy)methyl]-4-phenyl-4H-1,2,4-triazole-3-thiol

Structure

CAS

64013-53-2

Category

Heterocyclic Organic Compound

Synonyms

Ambcb7788303, MLS000662135, MolPort-002-268-992, NSC326174, CID978233, STK139556, SMR000294036, 5-[(2,6-dimethylphenoxy)methyl]-4-phenyl-4H-1,2,4-triazole-3-thiol, 64013-53-2

IUPAC Name

3-[(2,6-dimethylphenoxy)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione

Molecular Weight

311.401380 [g/mol]

Molecular Formula

C₁₇H₁₇N₃OS

Canonical SMILES

CC1=C(C(=CC=C1)C)OCC2=NNC(=S)N2C3=CC=CC=C3

InChI Key

LWXUOBXLPCBGRG-UHFFFAOYSA-N

Boiling Point

433.5ºC at 760 mmHg

Flash Point

216ºC

Density

1.22g/cm³

Exact Mass

311.10900

H-Bond Acceptor

H-Bond Donor

MSDS

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COA

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Spec Sheet

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