2,4,5-Trifluoroiodobenzene - CAS 17533-08-3
Catalog: |
BB013123 |
Product Name: |
2,4,5-Trifluoroiodobenzene |
CAS: |
17533-08-3 |
Synonyms: |
1,2,4-trifluoro-5-iodobenzene; 1,2,4-trifluoro-5-iodobenzene |
IUPAC Name: | 1,2,4-trifluoro-5-iodobenzene |
Description: | 2,4,5-Trifluoroiodobenzene (CAS# 17533-08-3) is a useful research chemical. |
Molecular Weight: | 257.98 |
Molecular Formula: | C6H2F3I |
Canonical SMILES: | C1=C(C(=CC(=C1F)I)F)F |
InChI: | InChI=1S/C6H2F3I/c7-3-1-5(9)6(10)2-4(3)8/h1-2H |
InChI Key: | UPCKPWDYXMTASO-UHFFFAOYSA-N |
Boiling Point: | 179.7 ℃ at 760 mmHg |
Density: | 2.078 g/cm3 |
LogP: | 2.70850 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021091823-A1 | Small molecule prostagladin transport inhibitors | 20191106 |
WO-2021015522-A1 | Novel compound and organic light emitting device comprising same | 20190724 |
EP-3237416-B1 | Polycyclic-carbamoylpyridone compounds and their pharmaceutical use | 20141223 |
WO-2016106237-A1 | Polycyclic-carbamoylpyridone compounds and their pharmaceutical use | 20141223 |
CN-102153559-A | Novel method for synthesizing sitagliptin phosphate and derivative thereof | 20110228 |
Complexity: | 120 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 257.91533 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 257.91533 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 0 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.9 |
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