2-Chloro-4-(trifluoromethyl)benzenesulfonyl chloride - CAS 175205-54-6
Catalog: |
BB013098 |
Product Name: |
2-Chloro-4-(trifluoromethyl)benzenesulfonyl chloride |
CAS: |
175205-54-6 |
Synonyms: |
2-chloro-4-(trifluoromethyl)benzenesulfonyl chloride |
IUPAC Name: | 2-chloro-4-(trifluoromethyl)benzenesulfonyl chloride |
Description: | 2-Chloro-4-(trifluoromethyl)benzenesulfonyl chloride (CAS# 175205-54-6) is a useful research chemical. |
Molecular Weight: | 279.06 |
Molecular Formula: | C7H3Cl2F3O2S |
Canonical SMILES: | C1=CC(=C(C=C1C(F)(F)F)Cl)S(=O)(=O)Cl |
InChI: | InChI=1S/C7H3Cl2F3O2S/c8-5-3-4(7(10,11)12)1-2-6(5)15(9,13)14/h1-3H |
InChI Key: | NJXDBSSSDPOAFI-UHFFFAOYSA-N |
Boiling Point: | 80-71 °C (1 torr) |
Density: | 2.225 g/cm3 |
Appearance: | Solid |
MDL: | MFCD00052912 |
LogP: | 4.36710 |
GHS Hazard Statement: | H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] |
Precautionary Statement: | P260, P261, P264, P272, P280, P301+P330+P331, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P333+P313, P363, P405, and P501 |
Signal Word: | Danger |
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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 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.5 |
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