| CAS Number | 118724-99-5 |
| Catalog Number | AG0097TN(AGN-PC-07AUSK) |
| Chemical Name | 2-(2-Acetamido-2-methylpropanamido)-2-methylpropanoic acid |
| IUPAC Name | 2-[(2-acetamido-2-methylpropanoyl)amino]-2-methylpropanoic acid |
| InChI | InChI=1S/C10H18N2O4/c1-6(13)11-9(2,3)7(14)12-10(4,5)8(15)16/h1-5H3,(H,11,13)(H,12,14)(H,15,16) |
| InChI Key | IGBQCFANGWYUSJ-UHFFFAOYSA-N |
| MDL Number | MFCD18824104 |
| Molecular Formula | C10H18N2O4 |
| Molecular Weight | 230.2609 |
| SMILES | CC(NC(C(NC(C(O)=O)(C)C)=O)(C)C)=O |
| Synonyms | 118724-99-5,
2-(2-ACETAMIDO-2-METHYLPROPANAMIDO)-2-METHYLPROPANOIC ACID,
CTK8G6533,
MFCD18824104,
ZINC39135820,
AKOS027395881,
Z2679906825,
Alanine, N-(N-acetyl-2-methylalanyl)-2-methyl- (9CI),
IGBQCFANGWYUSJ-UHFFFAOYSA-N,
Alanine, N-(N-acetyl-2-methylalanyl)-2-methyl- (9CI),
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| Complexity | 321 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 230.127g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 230.264g/mol |
| Monoisotopic Mass | 230.127g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 95.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number