| CAS Number | 110192-48-8 |
| Catalog Number | AG00HBOY(AGN-PC-07XRN4) |
| Chemical Name | Benzene, 1-fluoro-2-iodo-4-(trifluoromethyl)- |
| IUPAC Name | 1-fluoro-2-iodo-4-(trifluoromethyl)benzene |
| InChI | InChI=1S/C7H3F4I/c8-5-2-1-4(3-6(5)12)7(9,10)11/h1-3H |
| InChI Key | MYEWQVPSCXXERV-UHFFFAOYSA-N |
| MDL Number | MFCD09800715 |
| Molecular Formula | C7H3F4I |
| Molecular Weight | 289.9968 |
| SMILES | c1(c(ccc(c1)C(F)(F)F)F)I |
| Synonyms | 1-Fluoro-2-iodo-4-(trifluoromethyl)benzene,
110192-48-8,
4-Fluoro-3-iodobenzotrifluoride,
Benzene, 1-fluoro-2-iodo-4-(trifluoromethyl)-,
SCHEMBL319516,
DTXSID70673780,
MYEWQVPSCXXERV-UHFFFAOYSA-N,
1941AA,
8703AC,
ZINC57861915,
FS-5408,
AJ-113051,
FT-0742361,
1-fluoranyl-2-iodanyl-4-(trifluoromethyl)benzene,
ethyl 3-fluorobenzoylformate,
C7H3F4I,
C10H9FO3,
110193-59-4,
|
| Complexity | 156 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 289.922g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 289.999g/mol |
| Monoisotopic Mass | 289.922g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.6 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number