| CAS Number | 103956-05-4 |
| Catalog Number | AG00IYN6(AGN-PC-00O8S8) |
| Chemical Name | 3-amino-N-(2-hydroxyethyl)benzamide |
| IUPAC Name | 3-amino-N-(2-hydroxyethyl)benzamide |
| InChI | InChI=1S/C9H12N2O2/c10-8-3-1-2-7(6-8)9(13)11-4-5-12/h1-3,6,12H,4-5,10H2,(H,11,13) |
| InChI Key | GGNCHYPESPHBPJ-UHFFFAOYSA-N |
| MDL Number | MFCD11642873 |
| Molecular Formula | C9H12N2O2 |
| Molecular Weight | 180.2038 |
| SMILES | NC1=CC(C(NCCO)=O)=CC=C1 |
| Synonyms | 3-amino-N-(2-hydroxyethyl)benzamide,
103956-05-4,
3-amino-N-(2-hydroxyethyl)benzenecarboxamide,
SCHEMBL3650167,
KS-00001YZI,
BBL011215,
MFCD11642873,
STK934690,
ZINC37382938,
N-(2-Hydroxyethyl)-3-aminobenzamide,
AKOS000283206,
MCULE-5497441018,
3-Amino-N-(2-hydroxy-ethyl)-benzamide,
Benzamide, 3-amino-N-(2-hydroxyethyl)-,
BB 0242909,
FT-0742412,
6X-9020,
|
| Complexity | 173 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 180.09g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 180.207g/mol |
| Monoisotopic Mass | 180.09g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 75.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number