| CAS Number | 771-05-1 |
| Catalog Number | AG005EEX(AGN-PC-0JNSK1) |
| Chemical Name | 1,5-Difluoro-3-iodo-2-nitrobenzene |
| IUPAC Name | 1,5-difluoro-3-iodo-2-nitrobenzene |
| InChI | InChI=1S/C6H2F2INO2/c7-3-1-4(8)6(10(11)12)5(9)2-3/h1-2H |
| InChI Key | ZSKLGMYXOHTYOW-UHFFFAOYSA-N |
| MDL Number | MFCD28789226 |
| Molecular Formula | C6H2F2INO2 |
| Molecular Weight | 284.9869 |
| NSC Number | 80202 |
| SMILES | [O-][N+](C1=C(I)C=C(F)C=C1F)=O |
| Synonyms | 1,5-difluoro-3-iodo-2-nitrobenzene,
771-05-1,
NSC80202,
AC1L5RJK,
CTK5E3855,
KS-00000TIK,
DTXSID30292072,
ZINC1596422,
4.6-Difluor-2-iod-1-nitro-benzol,
MFCD28789226,
NSC-80202,
AKOS027267155,
AK226439,
DS-10450,
CID255044,
|
| Complexity | 187 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 284.91g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 284.988g/mol |
| Monoisotopic Mass | 284.91g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 45.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number