2,6-Difluoro-3-methylbenzoyl chloride - CAS 261763-39-7
Catalog: |
BB019174 |
Product Name: |
2,6-Difluoro-3-methylbenzoyl chloride |
CAS: |
261763-39-7 |
Synonyms: |
2,6-difluoro-3-methylbenzoyl chloride |
IUPAC Name: | 2,6-difluoro-3-methylbenzoyl chloride |
Description: | 2,6-Difluoro-3-methylbenzoyl chloride (CAS# 261763-39-7) is a useful research chemical. |
Molecular Weight: | 190.57 |
Molecular Formula: | C8H5ClF2O |
Canonical SMILES: | CC1=C(C(=C(C=C1)F)C(=O)Cl)F |
InChI: | InChI=1S/C8H5ClF2O/c1-4-2-3-5(10)6(7(4)11)8(9)12/h2-3H,1H3 |
InChI Key: | LXCIIPPXRHOCQN-UHFFFAOYSA-N |
Boiling Point: | 203.1 °C at 760 mmHg |
Purity: | 95 % |
Density: | 1.3114 g/cm3 |
Appearance: | Colorless to light yellow liquid |
MDL: | MFCD01631334 |
LogP: | 2.65220 |
GHS Hazard Statement: | H302 (88.37%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P260, P264, P270, P280, P301+P312, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P330, P363, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
US-2014357612-A1 | Compounds for kinase modulation, and indications therefor | 20130530 |
DE-112012004805-T5 | Method of treating leishmaniasis | 20111118 |
US-2014336187-A1 | Methods for treating leishmaniasis | 20111118 |
US-2015073177-A1 | Method for inhibiting trypanosoma cruzi | 20110727 |
US-9422231-B2 | Method for inhibiting Trypanosoma cruzi | 20110727 |
Complexity: | 186 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 189.9996988 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 189.9996988 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 17.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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