4-(3-methylbutanoyl)-1H-pyrrole-2-carboxylic acid
4-(3-methylbutanoyl)-1H-pyrrole-2-carboxylic acid
Also Known As: 4-(3-methylbutanoyl)-1H-pyrrole-2-carboxylic acid|Oprea1_339704|KS-000020R6|4-(3-methylbutanoyl)-1H-pyrrole-2-carboxylicacid|8R-0286|1H-Pyrrole-2-carboxylicacid,4-(3-methyl-1-oxobutyl)-(9CI)|1H-PYRROLE-2-CARBOXYLIC ACID, 4-(3-METHYL-1-OXOBUTYL)-|1H-Pyrrole-2-carboxylic acid, 4-(3-methyl-1-oxobutyl)- (9CI)
CAS: 478259-56-2
| Molecular Formula | C10H13NO3 |
|---|---|
| Molecular Weight | 195.08954 g/mol |
| LogP | 1.9417 |
| Topological Polar Surface Area | 70.16 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 195.08954 |
| Monoisotopic Mass | 195.08954 |
| Heavy Atoms | 14 |
| Complexity | 352.00403 |
Chemical Identifiers
| CAS Number | 478259-56-2 |
|---|---|
| SMILES | CC(C)CC(=O)C1=CNC(=C1)C(=O)O |
Product Overview
4-(3-methylbutanoyl)-1H-pyrrole-2-carboxylic acid (CAS 478259-56-2), with molecular formula C10H13NO3 and molecular weight 195.08954 g/mol. IUPAC: 4-(3-methylbutanoyl)-1H-pyrrole-2-carboxylic acid.
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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