| CAS Number | 1141930-90-6 |
| Catalog Number | AG01BEJL |
| Chemical Name | 4-hydroxy-N-[(2S)-2-hydroxypropyl]benzamide |
| IUPAC Name | 4-hydroxy-N-(2-hydroxypropyl)benzamide |
| InChI | InChI=1S/C10H13NO3/c1-7(12)6-11-10(14)8-2-4-9(13)5-3-8/h2-5,7,12-13H,6H2,1H3,(H,11,14) |
| InChI Key | NYGFEEOHVNIUEK-UHFFFAOYSA-N |
| MDL Number | MFCD24363662 |
| Molecular Formula | C10H13NO3 |
| Molecular Weight | 195.2151 |
| SMILES | C[C@@H](CNC(C1=CC=C(O)C=C1)=O)O |
| Synonyms | 4-hydroxy-N-(2-hydroxypropyl)benzamide,
98034-09-4,
N-(2-hydroxypropyl)-4-hydroxybenzamide,
1141930-90-6,
SCHEMBL9668334,
AKOS008976789,
4-hydroxy-N-[(2S)-2-hydroxypropyl]benzamide,
|
| Complexity | 188 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 195.09g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 195.218g/mol |
| Monoisotopic Mass | 195.09g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 69.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number