| CAS Number | 73655-51-3 |
| Catalog Number | AG008QE9(AGN-PC-0WNU65) |
| Chemical Name | 4-Amino-2-iodobenzoic acid |
| IUPAC Name | 4-amino-2-iodobenzoic acid |
| InChI | InChI=1S/C7H6INO2/c8-6-3-4(9)1-2-5(6)7(10)11/h1-3H,9H2,(H,10,11) |
| InChI Key | BECAAKAVMYEKLN-UHFFFAOYSA-N |
| MDL Number | MFCD16547805 |
| Molecular Formula | C7H6INO2 |
| Molecular Weight | 263.0325 |
| SMILES | NC1=CC(I)=C(C(O)=O)C=C1 |
| Synonyms | 4-amino-2-iodobenzoic acid,
73655-51-3,
4-AMino-2-iodo-benzoic acid,
2-IODO-4-AMINOBENZOIC ACID,
SCHEMBL255553,
AC1Q51P4,
CHEMBL3305244,
CTK5D8426,
DTXSID50559033,
STL450366,
ZINC34275240,
AKOS027278232,
MCULE-3357968662,
NE29430,
SC-69215,
EN300-89476,
Z1020801338,
4-Amino-2-iodobenzoicacid,
70110-25-7,
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| Complexity | 163 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 262.944g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 263.034g/mol |
| Monoisotopic Mass | 262.944g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 63.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number