| CAS Number | 94319-83-2 |
| Catalog Number | AG019M5Q(AGN-PC-0W3X7W) |
| Chemical Name | N-(2-aminoethyl)-2-chlorobenzamide hydrochloride |
| IUPAC Name | N-(2-aminoethyl)-2-chlorobenzamide;hydrochloride |
| InChI | InChI=1S/C9H11ClN2O.ClH/c10-8-4-2-1-3-7(8)9(13)12-6-5-11;/h1-4H,5-6,11H2,(H,12,13);1H |
| InChI Key | RBXHARJYLYRYSI-UHFFFAOYSA-N |
| MDL Number | MFCD11099405 |
| Molecular Formula | C9H12Cl2N2O |
| Molecular Weight | 235.1104 |
| SMILES | O=C(NCCN)C1=CC=CC=C1Cl.[H]Cl |
| Synonyms | N-(2-aminoethyl)-2-chlorobenzamide hydrochloride,
94319-83-2,
AC1Q3DDG,
SCHEMBL2990660,
CTK7E8833,
RBXHARJYLYRYSI-UHFFFAOYSA-N,
MCULE-8240682104,
NE20421,
EN300-34859,
Z1250132251,
Benzamide, N-(2-aminoethyl)-2-chloro-, hydrochloride,
|
| Complexity | 175 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 234.033g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 235.108g/mol |
| Monoisotopic Mass | 234.033g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 55.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number