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Home> Encyclopedia > Hot Product Listed X   > XJTPQWBMYWHCOC-UHFFFAOYSA-N
885950-92-5 structure

XJTPQWBMYWHCOC-UHFFFAOYSA-N

Iupac Name:3-(3,5-dichlorophenyl)benzenesulfonyl chloride
CAS No.:885950-92-5
Molecular Weight:321.596
Molecular Formula:C12H7Cl3O2S (isomer)
Names and Identifiers
Synonyms

[3-(3,5-dichlorophenyl)phenyl]sulfonyl chloride [3-(3,5-dichlorophenyl)phenyl]sulphonyl chloride 3-(3,5-dichlorophenyl)benzenesulfonyl chloride 3',5'-dichloro-[1,1'-biphenyl]-3-sulfonyl chloride 3',5'-dichlorobiphenyl-3-sulfonyl chloride 3PNS-Q03-0 AC1MUZFF AK192479 AKOS026671265 AR1679 KB-28609 mfcd01631883 OR12585 SCHEMBL9997221 X-2217 ZINC100006195 zx-at029406

Inchi
InChI=1S/C12H7Cl3O2S/c13-10-4-9(5-11(14)7-10)8-2-1-3-12(6-8)18(15,16)17/h1-7H
InChkey
XJTPQWBMYWHCOC-UHFFFAOYSA-N
Canonical Smiles
C1=CC(=CC(=C1)S(=O)(=O)Cl)C2=CC(=CC(=C2)Cl)Cl
Computational chemical data
  • Molecular Weight:321.596g/mol
  • Molecular Formula:C12H7Cl3O2S
  • Compound Is Canonicalized:True
  • Exact Mass:319.923
  • Monoisotopic Mass:319.923
  • Complexity:369
  • Rotatable Bond Count:2
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:2
  • Heavy Atom Count:18
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
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Recommended Suppliers
  • Tel:44 161 406 0505
  • Fax:44 161 405 0506
  • Tel:(33) 4 70 03 88 55
  • Fax:(33) 4 70 03 82 60
  • Tel:303 381 6600
  • Fax:303 381 6601
  • Tel:(852) 23902293
  • Fax:+852 2789 8314
 
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