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Home Sulfos 4-[3-(4-Fluoro-phenyl)-ureido]-2-methyl-benzene sulfonyl chloride

4-[3-(4-Fluoro-phenyl)-ureido]-2-methyl-benzene sulfonyl chloride

CAS No.:
677327-10-5
Catalog Number:
AG01EWW3
Molecular Formula:
C14H12ClFN2O3S
Molecular Weight:
342.7731
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Product Description
Catalog Number:
AG01EWW3
Chemical Name:
4-[3-(4-Fluoro-phenyl)-ureido]-2-methyl-benzene sulfonyl chloride
CAS Number:
677327-10-5
Molecular Formula:
C14H12ClFN2O3S
Molecular Weight:
342.7731
MDL Number:
MFCD03424877
IUPAC Name:
4-[(4-fluorophenyl)carbamoylamino]-2-methylbenzenesulfonyl chloride
InChI:
InChI=1S/C14H12ClFN2O3S/c1-9-8-12(6-7-13(9)22(15,20)21)18-14(19)17-11-4-2-10(16)3-5-11/h2-8H,1H3,(H2,17,18,19)
InChI Key:
GEZVBRLDHUYOTF-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccc(cc1)F)Nc1ccc(c(c1)C)S(=O)(=O)Cl
Properties
Complexity:
489  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
342.024g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
342.769g/mol
Monoisotopic Mass:
342.024g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
83.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties