| CAS Number | 1153234-38-8 |
| Catalog Number | AG019J8S |
| Chemical Name | 2-[2-(methylamino)acetamido]benzoic acid hydrochloride |
| IUPAC Name | 2-[[2-(methylamino)acetyl]amino]benzoic acid;hydrochloride |
| InChI | InChI=1S/C10H12N2O3.ClH/c1-11-6-9(13)12-8-5-3-2-4-7(8)10(14)15;/h2-5,11H,6H2,1H3,(H,12,13)(H,14,15);1H |
| InChI Key | XDYUTICSOITAFH-UHFFFAOYSA-N |
| MDL Number | MFCD07286910 |
| Molecular Formula | C10H13ClN2O3 |
| Molecular Weight | 244.6748 |
| SMILES | Cl.CNCC(NC1=C(C(O)=O)C=CC=C1)=O |
| Synonyms | 2-[2-(methylamino)acetamido]benzoic acid hydrochloride,
1153234-38-8,
2-{[(methylamino)acetyl]amino}benzoic acid hydrochloride,
AC1Q3BRH,
CTK6I5192,
MCULE-5565425641,
NE36247,
EN300-08834,
|
| Complexity | 243 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 244.061g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 244.675g/mol |
| Monoisotopic Mass | 244.061g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 78.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number