| CAS Number | 499157-23-2 |
| Catalog Number | AG01DWGA(AGN-PC-0BED6P) |
| Chemical Name | methyl 4-amino-3-hydroxybenzoate hydrochloride |
| IUPAC Name | methyl 4-amino-3-hydroxybenzoate;hydrochloride |
| InChI | InChI=1S/C8H9NO3.ClH/c1-12-8(11)5-2-3-6(9)7(10)4-5;/h2-4,10H,9H2,1H3;1H |
| InChI Key | UVNWERBBTPQNME-UHFFFAOYSA-N |
| MDL Number | MFCD20492665 |
| Molecular Formula | C8H10ClNO3 |
| Molecular Weight | 203.6229 |
| SMILES | Cl.COC(C1=CC(O)=C(N)C=C1)=O |
| Synonyms | Methyl 4-amino-3-hydroxybenzoate hydrochloride,
SCHEMBL2972630,
UVNWERBBTPQNME-UHFFFAOYSA-N,
AKOS007930253,
4-amino-3-hydroxybenzoic acid methyl ester hydrochloride,
499157-23-2,
|
| Complexity | 172 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 203.034921g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 203.62g/mol |
| Monoisotopic Mass | 203.034921g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 72.6Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number