| CAS Number | 872851-33-7 |
| Catalog Number | AG01DKT5(AGN-PC-02UNP7) |
| Chemical Name | O-4-Chlorobenzoylhydroxylamine |
| IUPAC Name | amino 4-chlorobenzoate |
| InChI | InChI=1S/C7H6ClNO2/c8-6-3-1-5(2-4-6)7(10)11-9/h1-4H,9H2 |
| InChI Key | KZZSHJUUEFFXJQ-UHFFFAOYSA-N |
| MDL Number | MFCD22370138 |
| Molecular Formula | C7H6ClNO2 |
| Molecular Weight | 171.5810 |
| SMILES | NOC(=O)c1ccc(cc1)Cl |
| Synonyms | O-4-Chlorobenzoylhydroxylamine,
872851-33-7,
O-(4-chlorobenzoyl)hydroxylamine,
O-4-chlorobenzoyl hydroxyamine,
SCHEMBL1969939,
4-Chlorobenzoic acid amino ester,
KZZSHJUUEFFXJQ-UHFFFAOYSA-N,
MFCD22370138,
ZINC95100059,
AKOS025310562,
O-4-Chlorobenzoylhydroxylamine, AldrichCPR,
|
| Complexity | 143 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 171.009g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 171.58g/mol |
| Monoisotopic Mass | 171.009g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 52.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number