2,4-Dichlorobenzenesulfonyl chloride - CAS 16271-33-3
Catalog: |
BB011896 |
Product Name: |
2,4-Dichlorobenzenesulfonyl chloride |
CAS: |
16271-33-3 |
Synonyms: |
2,4-dichlorobenzenesulfonyl chloride |
IUPAC Name: | 2,4-dichlorobenzenesulfonyl chloride |
Description: | 2,4-Dichlorobenzenesulfonyl chloride (CAS# 16271-33-3) is a useful research chemical. |
Molecular Weight: | 245.51 |
Molecular Formula: | C6H3Cl3O2S |
Canonical SMILES: | C1=CC(=C(C=C1Cl)Cl)S(=O)(=O)Cl |
InChI: | InChI=1S/C6H3Cl3O2S/c7-4-1-2-6(5(8)3-4)12(9,10)11/h1-3H |
InChI Key: | FDTPBIKNYWQLAE-UHFFFAOYSA-N |
Boiling Point: | 308.4 °C at 760 mmHg |
Melting Point: | 54-58 °C |
Purity: | 98 % |
Density: | 1.636 g/cm3 |
Appearance: | White to light beige crystalline powder |
MDL: | MFCD00052712 |
LogP: | 4.00170 |
GHS Hazard Statement: | H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] |
Precautionary Statement: | P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501 |
Signal Word: | Danger |
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PMID | Publication Date | Title | Journal |
22219869 | 20111101 | 2,4-Dichloro-N-(2,4-dimethyl-phen-yl)benzene-sulfonamide | Acta crystallographica. Section E, Structure reports online |
22219885 | 20111101 | 2,4-Dichloro-N-(3,5-dimethyl-phen-yl)benzene-sulfonamide | Acta crystallographica. Section E, Structure reports online |
22219928 | 20111101 | 2,4-Dichloro-N-(2,3-dichloro-phen-yl)benzene-sulfonamide | Acta crystallographica. Section E, Structure reports online |
22219998 | 20111101 | 2,4-Dichloro-N-(3,5-dichloro-phen-yl)benzene-sulfonamide | Acta crystallographica. Section E, Structure reports online |
22064772 | 20111001 | 2,4-Dichloro-N-(2,6-dimethyl-phen-yl)benzene-sulfonamide | Acta crystallographica. Section E, Structure reports online |
Complexity: | 246 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 243.891934 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 243.891934 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 42.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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