2,6-Difluoro-3-iodobenzoic Acid - CAS 229178-74-9
Catalog: |
BB017814 |
Product Name: |
2,6-Difluoro-3-iodobenzoic Acid |
CAS: |
229178-74-9 |
Synonyms: |
2,6-difluoro-3-iodobenzoic acid; 2,6-difluoro-3-iodobenzoic acid |
IUPAC Name: | 2,6-difluoro-3-iodobenzoic acid |
Description: | 2,6-Difluoro-3-iodobenzoic Acid (CAS# 229178-74-9) is a useful research chemical. |
Molecular Weight: | 284.00 |
Molecular Formula: | C7H3F2IO2 |
Canonical SMILES: | C1=CC(=C(C(=C1F)C(=O)O)F)I |
InChI: | InChI=1S/C7H3F2IO2/c8-3-1-2-4(10)6(9)5(3)7(11)12/h1-2H,(H,11,12) |
InChI Key: | LBYMGWJMJSYYKG-UHFFFAOYSA-N |
Boiling Point: | 311.1 °C at 760 mmHg |
Density: | 2.144 g/cm3 |
MDL: | MFCD11040446 |
LogP: | 2.26760 |
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-2012150208-A1 | Use of substituted benzyl alcohol esters of cyclopropanecarboxylic acid for controlling insecticide-resistant insects | 20110504 |
WO-2012150221-A2 | Novel halogenated benzyl alcohol esters of cyclopropane carboxylic acid as pest control agents | 20110504 |
US-2011021486-A1 | Viral polymerase inhibitors | 20071219 |
US-2012214783-A1 | Viral polymerase inhibitors | 20071219 |
US-2013331391-A1 | Viral polymerase inhibitors | 20071219 |
Complexity: | 188 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 283.91458 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 283.91458 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 37.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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