3-Methyl-2-(phenylformamido)butanoic acid
2-benzamido-3-methylbutanoic acid
Also Known As: Benzoyl-dl-valine|N-Benzoylvaline|2-benzamido-3-methylbutanoic acid|Bz-Val-OH|Valine, N-benzoyl-|Benzoyl-L-Valine|N-Benzoyl-dl-valine|N-Benzoylvaline #|N-Benzoyl-D-valine|Benzoyl-DL-Val-OH|D-Valine, N-benzoyl-|N-(phenylcarbonyl)valine|ACMC-1CFRX|3-methyl-2-(phenylformamido)butanoic acid|Oprea1_556734|Oprea1_714359|CBDivE_002999|2-Benzoylamino-3-methyl-butyric acid|2-(Benzoylamino)isovaleric acid|2-(benzoylamino)-3-methylbutanoic acid|MIYQNOPLWKCHED-UHFFFAOYSA-|2-benzamido-3-methyl-butanoic acid|KS-00000FQ3|KS-00003WJ2|(S)-2-Benzamido-3-methylbutanoic acid|2-Benzoylamino-3-methyl-butyricacid|NP2753
| Molecular Formula | C12H15NO3 |
|---|---|
| Molecular Weight | 221.1052 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 221.1052 |
| Monoisotopic Mass | 221.1052 |
| Heavy Atoms | 16 |
| Complexity | 257.0 |
Chemical Identifiers
| CAS Number | 3965-55-7 |
|---|---|
| SMILES | CC(C)C(C(=O)O)NC(=O)C1=CC=CC=C1 |
| InChIKey | MIYQNOPLWKCHED-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Methyl-2-(phenylformamido)butanoic acid (CAS 3965-55-7), with molecular formula C12H15NO3 and molecular weight 221.1052 g/mol. IUPAC: 2-benzamido-3-methylbutanoic acid.