| CAS Number | 55897-04-6 |
| Catalog Number | AG01A43K(AGN-PC-0NI5GJ) |
| Chemical Name | Ethyl 2-sulfamoylacetate |
| IUPAC Name | ethyl 2-sulfamoylacetate |
| InChI | InChI=1S/C4H9NO4S/c1-2-9-4(6)3-10(5,7)8/h2-3H2,1H3,(H2,5,7,8) |
| InChI Key | MBUPBHNRKOZUAT-UHFFFAOYSA-N |
| MDL Number | MFCD12783410 |
| Molecular Formula | C4H9NO4S |
| Molecular Weight | 167.1836 |
| SMILES | O=C(OCC)CS(=O)(N)=O |
| Synonyms | ethyl 2-sulfamoylacetate,
55897-04-6,
SCHEMBL437357,
Ethoxycarbonylmethane Sulfonamide,
MBUPBHNRKOZUAT-UHFFFAOYSA-N,
6701AJ,
ZINC38136964,
AKOS010297120,
NE27460,
SY029545,
MFCD12783410 (95%),
C4H9NO4S,
2-(aminosulfonyl)Acetic acid ethyl ester,
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| Complexity | 202 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 167.025g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 167.179g/mol |
| Monoisotopic Mass | 167.025g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 94.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number