3-(3,4-Dimethyl-phenyl)-2-mercapto-3H-quinazolin-4-one

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Catalog Number

ACM84772258

Product Name

Structure

CAS

84772-25-8

Category

Heterocyclic Organic Compound

Synonyms

Oprea1_428185, MolPort-000-869-279, MolPort-003-249-024, NSC146567, ZINC03263982, CID2380520, EU-0061211, EN300-03037, PB-90165715, 84772-25-8

IUPAC Name

3-(3,4-dimethylphenyl)-2-sulfanylidene-1H-quinazolin-4-one

Molecular Weight

282.359

Molecular Formula

C₁₆H₁₄N₂OS

Canonical SMILES

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3NC2=S)C

InChI Key

LDGVGGRFBWCZTP-UHFFFAOYSA-N

Boiling Point

465.1ºC at 760 mmHg

Flash Point

235.1ºC

Density

1.33g/cm³

Exact Mass

282.08300

H-Bond Acceptor

H-Bond Donor

MSDS

COA

Spec Sheet

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