| CAS Number | 1258639-29-0 |
| Catalog Number | AG01AAB1 |
| Chemical Name | 2-(2-chlorophenyl)-2-(methylamino)acetic acid hydrochloride |
| IUPAC Name | 2-(2-chlorophenyl)-2-(methylamino)acetic acid;hydrochloride |
| InChI | InChI=1S/C9H10ClNO2.ClH/c1-11-8(9(12)13)6-4-2-3-5-7(6)10;/h2-5,8,11H,1H3,(H,12,13);1H |
| InChI Key | URQFUONGRIQTSW-UHFFFAOYSA-N |
| MDL Number | MFCD17167145 |
| Molecular Formula | C9H11Cl2NO2 |
| Molecular Weight | 236.0951 |
| SMILES | Cl.CNC(C1=C(Cl)C=CC=C1)C(O)=O |
| Synonyms | 2-(2-chlorophenyl)-2-(methylamino)acetic acid hydrochloride,
1258639-29-0,
AC1Q3BOW,
SCHEMBL1160125,
NE24856,
EN300-67672,
Z1160899454,
|
| Complexity | 187 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 235.017g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 236.092g/mol |
| Monoisotopic Mass | 235.017g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 49.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number