| CAS Number | 1160575-07-4 |
| Catalog Number | AG00HDOR |
| Chemical Name | 2,6-Difluoro-4-iodobenzoic acid |
| IUPAC Name | 2,6-difluoro-4-iodobenzoic acid |
| InChI | InChI=1S/C7H3F2IO2/c8-4-1-3(10)2-5(9)6(4)7(11)12/h1-2H,(H,11,12) |
| InChI Key | UZSFGVPHIUMKOY-UHFFFAOYSA-N |
| MDL Number | MFCD11845965 |
| Molecular Formula | C7H3F2IO2 |
| Molecular Weight | 283.9988 |
| SMILES | c1(c(c(cc(c1)I)F)C(=O)O)F |
| Synonyms | 2,6-Difluoro-4-iodobenzoic acid,
1160575-07-4,
ZX-AP010468,
MFCD11845965,
ZINC36532774,
AKOS024263491,
FCH1406114,
PC10669,
AS-43740,
|
| Complexity | 176 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 283.915g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 284g/mol |
| Monoisotopic Mass | 283.915g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number