| CAS Number | 1696665-38-9 |
| Catalog Number | AG01DIOT |
| Chemical Name | methyl 3-(2-chloroacetamido)-2-hydroxypropanoate |
| IUPAC Name | methyl 3-[(2-chloroacetyl)amino]-2-hydroxypropanoate |
| InChI | InChI=1S/C6H10ClNO4/c1-12-6(11)4(9)3-8-5(10)2-7/h4,9H,2-3H2,1H3,(H,8,10) |
| InChI Key | KXDWXXOJYCTGEN-UHFFFAOYSA-N |
| MDL Number | MFCD31731535 |
| Molecular Formula | C6H10ClNO4 |
| Molecular Weight | 195.6009 |
| SMILES | COC(=O)C(O)CNC(=O)CCl |
| Synonyms | Methyl 3-(2-chloroacetamido)-2-hydroxypropanoate,
1696665-38-9,
AS-67910,
CS-0079953,
|
| Complexity | 173 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 195.029835g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 195.6g/mol |
| Monoisotopic Mass | 195.029835g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 75.6Ų |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.6 |
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Certificate of Analysis
Lot Number