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100866-99-7 | Ethanone, 1-[4-[(4-aminophenyl)sulfonyl]phenyl]-
CAS No: 100866-99-7 Catalog No: AG00031T MDL No:
Product Description
Catalog Number:
AG00031T
Chemical Name:
Ethanone, 1-[4-[(4-aminophenyl)sulfonyl]phenyl]-
CAS Number:
100866-99-7
Molecular Formula:
C14H13NO3S
Molecular Weight:
275.3229
IUPAC Name:
1-[4-(4-aminophenyl)sulfonylphenyl]ethanone
InChI:
InChI=1S/C14H13NO3S/c1-10(16)11-2-6-13(7-3-11)19(17,18)14-8-4-12(15)5-9-14/h2-9H,15H2,1H3
InChI Key:
HGWHPLHKHGKPKK-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1)S(=O)(=O)c1ccc(cc1)C(=O)C
Properties
Complexity:
411
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.062g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
275.322g/mol
Monoisotopic Mass:
275.062g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
85.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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