3-Fluoro-4-iodotoluene - CAS 452-79-9
Catalog: |
BB025817 |
Product Name: |
3-Fluoro-4-iodotoluene |
CAS: |
452-79-9 |
Synonyms: |
2-fluoro-1-iodo-4-methylbenzene |
IUPAC Name: | 2-fluoro-1-iodo-4-methylbenzene |
Description: | 3-Fluoro-4-iodotoluene (CAS# 452-79-9) is a useful research chemical. |
Molecular Weight: | 236.03 |
Molecular Formula: | C7H6FI |
Canonical SMILES: | CC1=CC(=C(C=C1)I)F |
InChI: | InChI=1S/C7H6FI/c1-5-2-3-7(9)6(8)4-5/h2-4H,1H3 |
InChI Key: | XVHYSMVSLDIUCM-UHFFFAOYSA-N |
Boiling Point: | 138-139 ℃ |
Density: | 1.803 g/cm3 |
Appearance: | Colorless to light yellow liqui |
MDL: | MFCD00143162 |
LogP: | 2.73870 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-111440137-A | 3, 4-benzocoumarin derivative and preparation method and application thereof | 20200428 |
KR-20190130515-A | Compound and organic light emitting device comprising the same | 20180514 |
WO-2019221483-A1 | Compound and organic light emitting device comprising same | 20180514 |
CN-111527096-A | Compound and organic light emitting device including the same | 20180514 |
KR-102186095-B1 | Compound and organic light emitting device comprising the same | 20180514 |
Complexity: | 94.9 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 235.94983 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 235.94983 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 0 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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