| CAS Number | 129660-96-4 |
| Catalog Number | AG009F6T(AGN-PC-044E4K) |
| Chemical Name | 2-(N-(Phosphonomethyl)acetamido)acetic acid |
| IUPAC Name | 2-[acetyl(phosphonomethyl)amino]acetic acid |
| InChI | InChI=1S/C5H10NO6P/c1-4(7)6(2-5(8)9)3-13(10,11)12/h2-3H2,1H3,(H,8,9)(H2,10,11,12) |
| InChI Key | BFECXRMSKVFCNB-UHFFFAOYSA-N |
| MDL Number | MFCD14105596 |
| Molecular Formula | C5H10NO6P |
| Molecular Weight | 211.1098 |
| SMILES | P(=O)(O)(O)CN(C(C)=O)CC(=O)O |
| UNII | C18VQM3RI4 |
| Synonyms | N-Acetylglyphosate,
N-Acetyl Glyphosate,
UNII-C18VQM3RI4,
129660-96-4,
C18VQM3RI4,
N-Acetyl-N-(phosphonomethyl)glycine,
Glycine, N-acetyl-N-(phosphonomethyl)-,
SCHEMBL249304,
DTXSID30634650,
BFECXRMSKVFCNB-UHFFFAOYSA-N,
N-(phosphonomethyl)-N-acetylglycine,
N-(phosphonomethyl)-N-acetyl glycine,
ZINC77270242,
FT-0661249,
J3.568.743B,
|
| Complexity | 258 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 211.025g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 211.11g/mol |
| Monoisotopic Mass | 211.025g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 115A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -2.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number