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19188-63-7 | Benzenesulfonyl fluoride, 4-[(3-aminobenzoyl)amino]-
CAS No: 19188-63-7 Catalog No: AG002FJ8 MDL No:
Product Description
Catalog Number:
AG002FJ8
Chemical Name:
Benzenesulfonyl fluoride, 4-[(3-aminobenzoyl)amino]-
CAS Number:
19188-63-7
Molecular Formula:
C13H11FN2O3S
Molecular Weight:
294.3014
IUPAC Name:
4-[(3-aminobenzoyl)amino]benzenesulfonyl fluoride
InChI:
InChI=1S/C13H11FN2O3S/c14-20(18,19)12-6-4-11(5-7-12)16-13(17)9-2-1-3-10(15)8-9/h1-8H,15H2,(H,16,17)
InChI Key:
BCAQNDAJTOAGEU-UHFFFAOYSA-N
SMILES:
Nc1cccc(c1)C(=O)Nc1ccc(cc1)S(=O)(=O)F
NSC Number:
113914
Properties
Complexity:
441
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.047g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
294.3g/mol
Monoisotopic Mass:
294.047g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
97.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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