| CAS Number | 1354428-17-3 |
| Catalog Number | AG01DVWQ(AGN-PC-0WBE9K) |
| Chemical Name | 2,3-DIaminobenzoic acid hydrochloride |
| IUPAC Name | 2,3-diaminobenzoic acid;hydrochloride |
| InChI | InChI=1S/C7H8N2O2.ClH/c8-5-3-1-2-4(6(5)9)7(10)11;/h1-3H,8-9H2,(H,10,11);1H |
| InChI Key | OMWNWENDHSMOPJ-UHFFFAOYSA-N |
| MDL Number | MFCD16620364 |
| Molecular Formula | C7H9ClN2O2 |
| Molecular Weight | 188.6116 |
| SMILES | O=C(O)C1=CC=CC(N)=C1N.[H]Cl |
| Synonyms | 2,3-Diaminobenzoic acid hydrochloride,
1354428-17-3,
SCHEMBL4923242,
diaminobenzoic acid hydrochloride,
OMWNWENDHSMOPJ-UHFFFAOYSA-N,
9418AF,
AKOS006345916,
MCULE-8435489422,
Diaminobenzoic acid,
Benzoic acid, diamino-,
2,3-Diaminobenzoic acid,
C7H9ClN2O2,
C7-H8-N2-O2,
27576-04-1,
603-81-6,
|
| Complexity | 161 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 188.035g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 188.611g/mol |
| Monoisotopic Mass | 188.035g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 89.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number