Benzoicacid, 4-[[[(3-chloro-4-fluorophenyl)sulfonyl]amino]methyl]-


Chemical Name: Benzoicacid, 4-[[[(3-chloro-4-fluorophenyl)sulfonyl]amino]methyl]-
CAS Number: 690646-06-1
Product Number: AG005LRI(AGN-PC-0JYRX4)
Synonyms:
MDL No:
Molecular Formula: C14H11ClFNO4S
Molecular Weight: 343.7578

Identification/Properties


Computed Properties
Molecular Weight:
343.753g/mol
XLogP3:
2.6
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
5
Exact Mass:
343.008g/mol
Monoisotopic Mass:
343.008g/mol
Topological Polar Surface Area:
91.8A^2
Heavy Atom Count:
22
Formal Charge:
0
Complexity:
488
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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