AC1MPWWT
5-[(2,5-dimethylphenyl)methyl]-4-oxo-2-sulfanylidene-1H-pyrimidine-6-carbaldehyde
Also Known As: 5-[(2,5-dimethylphenyl)methyl]-4-oxo-2-sulfanylidene-1H-pyri|5-[(2,5-Dimethylphenyl)methyl]-6-oxo-2-sulfanylidene-1,2,3,6-tetrahydropyrimidine-4-carbaldehyde|5-[(2,5-dimethylphenyl)methyl]-4-oxo-2-sulfanylidene-1H-pyrimidine-6-carbaldehyde
CAS: 31349-87-8
| Molecular Formula | C14H14N2O2S |
|---|---|
| Molecular Weight | 274.0776 g/mol |
| LogP | 2.45263 |
| Topological Polar Surface Area | 65.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 274.0776 |
| Monoisotopic Mass | 274.0776 |
| Heavy Atoms | 19 |
| Complexity | 743.8417 |
Chemical Identifiers
| CAS Number | 31349-87-8 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)CC2=C(NC(=S)NC2=O)C=O |
Product Overview
AC1MPWWT (CAS 31349-87-8), with molecular formula C14H14N2O2S and molecular weight 274.0776 g/mol. IUPAC: 5-[(2,5-dimethylphenyl)methyl]-4-oxo-2-sulfanylidene-1H-pyrimidine-6-carbaldehyde.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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