AC1L539R
buta-1,3-diene;N-(hydroxymethyl)prop-2-enamide;2-methylprop-2-enoic acid;prop-2-enenitrile
Also Known As: buta-1,3-diene; n-(hydroxymethyl)prop-2-enamide; 2-methylprop-2-enoic acid; prop-2-enenitrile|1,3-Butadiene, 2-propenenitrile, 2-methyl-2-propenoic acid, N-hydroxymethyl-2-propenamide
CAS: 35446-13-0
| Molecular Formula | C15H22N2O4 |
|---|---|
| Molecular Weight | 294.15796 g/mol |
| LogP | 1.93988 |
| Topological Polar Surface Area | 110.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 294.15796 |
| Monoisotopic Mass | 294.15796 |
| Heavy Atoms | 21 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 35446-13-0 |
|---|---|
| SMILES | CC(=C)C(=O)O.C=CC=C.C=CC#N.C=CC(=O)NCO |
| InChIKey | QJTPWVWUSSQRAH-UHFFFAOYSA-N |
Product Overview
AC1L539R (CAS 35446-13-0), with molecular formula C15H22N2O4 and molecular weight 294.15796 g/mol. IUPAC: buta-1,3-diene;N-(hydroxymethyl)prop-2-enamide;2-methylprop-2-enoic acid;prop-2-enenitrile.
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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