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Home > Encyclopedia > [5-chloro-2-[(3,4-dichlorophenyl)carbamoylamino]phenyl] hydrogen sulfate

[5-chloro-2-[(3,4-dichlorophenyl)carbamoylamino]phenyl] hydrogen sulfate

[5-chloro-2-[(3,4-dichlorophenyl)carbamoylamino]phenyl] hydrogen sulfate structure

[5-chloro-2-[(3,4-dichlorophenyl)carbamoylamino]phenyl] hydrogen sulfate 

structure
  • CAS No:

    62950-30-5

  • Formula:

    C13H9Cl3N2O5S

  • Chemical Name:

    [5-chloro-2-[(3,4-dichlorophenyl)carbamoylamino]phenyl] hydrogen sulfate

  • Synonyms:

    62950-30-5;Urea, N-(4-chloro-2-(sulfooxy)phenyl)-N-(3,4-dichlorophenyl)-;2'-sulfooxytriclocarban;sulfate of 2'-OH TCC;2'-OSO3H TCC;TCC 2'-OSO3H;CHEMBL3527580;DTXSID80978793;CHEBI:142787;1-(4-chloro-2-sulfooxyphenyl)-3-(3,4-dichlorophenyl)urea;N-(4-chloro-2-(sulfooxy)phenyl)-N'-(3,4-dichlorophenyl)urea;5-chloro-2-{[(3,4-dichlorophenyl)carbamoyl]amino}phenyl hydrogen sulfate;N-[4-Chloro-2-(sulfooxy)phenyl]-N'-(3,4-dichlorophenyl)carbamimidic acid

Description

2'-sulfooxytriclocarban is a phenylurea that is urea substituted by 4-chloro-2-sulfooxyphenyl and 3,4-dichlorophenyl groups at positions 1 and 3 respectively. A metabolite of triclocarban. It is a dichlorobenzene, a member of monochlorobenzenes and a member of phenylureas.

[5-chloro-2-[(3,4-dichlorophenyl)carbamoylamino]phenyl] hydrogen sulfate Basic Attributes

411.6 g/mol

409.929776 g/mol

Characteristics

113 Ų

Computed Properties

Molecular Weight:411.6
XLogP3:3.4
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:409.929776
Monoisotopic Mass:409.929776
Topological Polar Surface Area:113
Heavy Atom Count:24
Complexity:544
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of [5-chloro-2-[(3,4-dichlorophenyl)carbamoylamino]phenyl] hydrogen sulfate

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