| CAS Number | 1260826-35-4 |
| Catalog Number | AG01BDZ1 |
| Chemical Name | 1,4-Difluoro-2-iodo-5-methylbenzene |
| IUPAC Name | 1,4-difluoro-2-iodo-5-methylbenzene |
| InChI | InChI=1S/C7H5F2I/c1-4-2-6(9)7(10)3-5(4)8/h2-3H,1H3 |
| InChI Key | WUALQZYOPFOPCT-UHFFFAOYSA-N |
| MDL Number | MFCD11847165 |
| Molecular Formula | C7H5F2I |
| Molecular Weight | 254.0159 |
| SMILES | CC1=C(F)C=C(I)C(F)=C1 |
| Synonyms | 1,4-DIFLUORO-2-IODO-5-METHYLBENZENE,
1260826-35-4,
SCHEMBL12583448,
ZINC89065440,
AKOS017561831,
MCULE-1808753292,
NE31876,
SC-32605,
Z1860991713,
|
| Complexity | 118 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 253.94g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 254.018g/mol |
| Monoisotopic Mass | 253.94g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
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Certificate of Analysis
Lot Number