3,5-Dichloro-2,4,6-trifluoropyridine - CAS 1737-93-5
Catalog: |
BB012956 |
Product Name: |
3,5-Dichloro-2,4,6-trifluoropyridine |
CAS: |
1737-93-5 |
Synonyms: |
3,5-dichloro-2,4,6-trifluoropyridine |
IUPAC Name: | 3,5-dichloro-2,4,6-trifluoropyridine |
Description: | 3,5-Dichloro-2,4,6-trifluoropyridine (CAS# 1737-93-5 ) is a useful research chemical. |
Molecular Weight: | 201.96 |
Molecular Formula: | C5Cl2F3N |
Canonical SMILES: | C1(=C(C(=NC(=C1Cl)F)F)Cl)F |
InChI: | InChI=1S/C5Cl2F3N/c6-1-3(8)2(7)5(10)11-4(1)9 |
InChI Key: | PKSORSNCSXBXOT-UHFFFAOYSA-N |
Boiling Point: | 159-160 ℃ |
Melting Point: | 23-24 ℃ |
Purity: | 95 % |
Density: | 1.622 g/cm3 |
Appearance: | A colorless liquid. |
Storage: | Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. |
MDL: | MFCD00006226 |
LogP: | 2.80570 |
GHS Hazard Statement: | H315 (99.01%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P260, P261, P264, P271, P280, P284, P302+P352, P304+P340, P305+P351+P338, P310, P312, P320, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
US-11066421-B1 | Synthetic cinchona alkaloids against cancer | 20210209 |
CN-112321497-A | Preparation method of 4-aminopyridine compound | 20201211 |
WO-2020118597-A1 | Process for making 1- [ (3r, 4s) -4-cyanotetrahydropyran-3-yl] -3- [ (2-fluoro-6-methoxy-4-pyridyl) amino] pyrazole-4-carboxamide | 20181213 |
WO-2020120673-A1 | Process for preparing 1-[(3r,4s)-4-cyanotetrahydropyran-3-yl]-3-[(2-fluoro-6-methoxy-4-pyridyl)amino]p yrazole-4-carboxamide | 20181213 |
CN-113227077-A | Method for preparing 1- [ (3R,4S) -4-cyano tetrahydropyran-3-yl ] -3- [ (2-fluoro-6-methoxy-4-pyridyl) amino ] pyrazole-4-formamide | 20181213 |
PMID | Publication Date | Title | Journal |
22504088 | 20120701 | In vitro study to determine decontamination of 3,5-dichloro-2,4,6-trifluoropyridine (DCTFP) from human skin | Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association |
15556447 | 20050101 | Density functional theory calculations and vibrational spectra of 3,5-dibromopyridine and 3,5-dichloro-2,4,6-trifluoropyridine | Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy |
Complexity: | 134 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 200.9359889 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 200.9359889 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 12.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.1 |
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