2-Chloro-6-(trifluoromethyl)benzenesulfonyl Chloride - CAS 874814-70-7
Catalog: |
BB038486 |
Product Name: |
2-Chloro-6-(trifluoromethyl)benzenesulfonyl Chloride |
CAS: |
874814-70-7 |
Synonyms: |
2-chloro-6-(trifluoromethyl)benzenesulfonyl chloride; 2-chloro-6-(trifluoromethyl)benzenesulfonyl chloride |
IUPAC Name: | 2-chloro-6-(trifluoromethyl)benzenesulfonyl chloride |
Description: | 2-Chloro-6-(trifluoromethyl)benzenesulfonyl Chloride (CAS# 874814-70-7) is a useful research chemical. |
Molecular Weight: | 279.06 |
Molecular Formula: | C7H3Cl2F3O2S |
Canonical SMILES: | C1=CC(=C(C(=C1)Cl)S(=O)(=O)Cl)C(F)(F)F |
InChI: | InChI=1S/C7H3Cl2F3O2S/c8-5-3-1-2-4(7(10,11)12)6(5)15(9,13)14/h1-3H |
InChI Key: | CFRDWFNMFKQQBA-UHFFFAOYSA-N |
MDL: | MFCD06408806 |
LogP: | 4.36710 |
Publication Number | Title | Priority Date |
US-2020115357-A1 | Liver x receptors (lxr) modulators | 20170410 |
US-2012071461-A1 | Substituted Benzamide Compounds | 20100922 |
US-8680159-B2 | Bradykinin 1 receptor modulating compounds | 20100922 |
WO-2012038081-A1 | Substituted benzamide compounds | 20100922 |
TW-I334778-B | Inhibitors of cytosolic phospholipase a2 | 20011203 |
Complexity: | 322 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 277.9182904 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 277.9182904 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 42.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.5 |
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