| CAS Number | 52944-27-1 |
| Catalog Number | AG01A105(AGN-PC-0SE1W7) |
| Chemical Name | 2-(3-Aminophenyl)-2-hydroxyacetic acid |
| IUPAC Name | 2-(3-aminophenyl)-2-hydroxyacetic acid |
| InChI | InChI=1S/C8H9NO3/c9-6-3-1-2-5(4-6)7(10)8(11)12/h1-4,7,10H,9H2,(H,11,12) |
| InChI Key | CSCYUKHWQGONIX-UHFFFAOYSA-N |
| MDL Number | MFCD20638626 |
| Molecular Formula | C8H9NO3 |
| Molecular Weight | 167.162 |
| SMILES | O=C(C(C1=CC(N)=CC=C1)O)O |
| Synonyms | 2-(3-aminophenyl)-2-hydroxyacetic acid,
52944-27-1,
SCHEMBL1094333,
AKOS022637350,
Z2301499814,
|
| Complexity | 172 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 167.058g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 167.164g/mol |
| Monoisotopic Mass | 167.058g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 83.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number