Acetyl-L-isoleucine methyl ester
methyl 2-acetamido-3-methylpentanoate
Also Known As: AC-ILE-OME|Acetyl-L-isoleucine methyl ester|methyl 2-acetamido-3-methylpentanoate|methyl 2-acetamido-3-methyl-pentanoate|DL-Isoleucine, N-acetyl-, methyl ester|methyl (2S,3S)-2-acetamido-3-methylpentanoate|Methyl 2-(acetylamino)-3-methylpentanoate #|(2S,3S)-Methyl 2-acetamido-3-methylpentanoate
CAS: 2256-76-0
| Molecular Formula | C9H17NO3 |
|---|---|
| Molecular Weight | 187.12085 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 187.12085 |
| Monoisotopic Mass | 187.12085 |
| Heavy Atoms | 13 |
| Complexity | 191.0 |
Chemical Identifiers
| CAS Number | 2256-76-0 |
|---|---|
| SMILES | CCC(C)C(C(=O)OC)NC(=O)C |
| InChIKey | JPQWQTHLAKUOOA-UHFFFAOYSA-N |
Product Overview
Acetyl-L-isoleucine methyl ester (CAS 2256-76-0), with molecular formula C9H17NO3 and molecular weight 187.12085 g/mol. IUPAC: methyl 2-acetamido-3-methylpentanoate.
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.
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