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89298-28-2 | Benzoic acid, 4-ethenyl-, 4-[(phenylamino)sulfonyl]phenyl ester
CAS No: 89298-28-2 Catalog No: AG0040CT MDL No:
Product Description
Catalog Number:
AG0040CT
Chemical Name:
Benzoic acid, 4-ethenyl-, 4-[(phenylamino)sulfonyl]phenyl ester
CAS Number:
89298-28-2
Molecular Formula:
C21H17NO4S
Molecular Weight:
379.4290
IUPAC Name:
[4-(phenylsulfamoyl)phenyl] 4-ethenylbenzoate
InChI:
InChI=1S/C21H17NO4S/c1-2-16-8-10-17(11-9-16)21(23)26-19-12-14-20(15-13-19)27(24,25)22-18-6-4-3-5-7-18/h2-15,22H,1H2
InChI Key:
WVYTWQCVKSIPEI-UHFFFAOYSA-N
SMILES:
C=Cc1ccc(cc1)C(=O)Oc1ccc(cc1)S(=O)(=O)Nc1ccccc1
Properties
Complexity:
590
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
379.088g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
379.43g/mol
Monoisotopic Mass:
379.088g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
80.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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