3-(Trifluoromethoxy)iodobenzene - CAS 198206-33-6
Catalog: |
BB015323 |
Product Name: |
3-(Trifluoromethoxy)iodobenzene |
CAS: |
198206-33-6 |
Synonyms: |
1-iodo-3-(trifluoromethoxy)benzene; 1-iodo-3-(trifluoromethoxy)benzene |
IUPAC Name: | 1-iodo-3-(trifluoromethoxy)benzene |
Description: | 3-(Trifluoromethoxy)iodobenzene (CAS# 198206-33-6) is a useful research chemical. |
Molecular Weight: | 288.01 |
Molecular Formula: | C7H4F3IO |
Canonical SMILES: | C1=CC(=CC(=C1)I)OC(F)(F)F |
InChI: | InChI=1S/C7H4F3IO/c8-7(9,10)12-6-3-1-2-5(11)4-6/h1-4H |
InChI Key: | UQZXQSQWKJZHCD-UHFFFAOYSA-N |
Boiling Point: | 185-186 °C |
Density: | 1.863 g/cm3 |
MDL: | MFCD01090992 |
LogP: | 3.18980 |
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 |
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Complexity: | 148 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 287.92590 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 287.92590 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 9.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.1 |
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