| CAS Number | 88512-39-4 |
| Catalog Number | AG01EH9Z(AGN-PC-0KVJH0) |
| Chemical Name | Ethyl n-(methylsulfonyl)glycinate |
| IUPAC Name | ethyl 2-(methanesulfonamido)acetate |
| InChI | InChI=1S/C5H11NO4S/c1-3-10-5(7)4-6-11(2,8)9/h6H,3-4H2,1-2H3 |
| InChI Key | MGCVGJVQIPYNKV-UHFFFAOYSA-N |
| MDL Number | MFCD01212943 |
| Molecular Formula | C5H11NO4S |
| Molecular Weight | 181.2101 |
| SMILES | CCOC(=O)CNS(=O)(=O)C |
| Synonyms | Ethyl N-(methylsulfonyl)glycinate,
88512-39-4,
N-Methylsulfonylglycine ethyl ester,
AC1MQORS,
ALBB-028640,
ethyl 2-(methanesulfonamido)acetate,
ZINC5458670,
MFCD01212943,
AKOS001851469,
CCG-139366,
MCULE-1045135879,
Glycine, N-(methylsulfonyl)-, ethyl ester,
Ethyl 2-methanesulfonamidoacetate,
CID3505144,
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| Complexity | 215 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 181.041g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 181.206g/mol |
| Monoisotopic Mass | 181.041g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 80.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number