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145865-89-0 | Benzoic acid, 2-[[2-[(4-chlorophenyl)methylene]hydrazinyl]sulfonyl]-, methyl ester
CAS No: 145865-89-0 Catalog No: AG001DH7 MDL No:
Product Description
Catalog Number:
AG001DH7
Chemical Name:
Benzoic acid, 2-[[2-[(4-chlorophenyl)methylene]hydrazinyl]sulfonyl]-, methyl ester
CAS Number:
145865-89-0
Molecular Formula:
C15H13ClN2O4S
Molecular Weight:
352.7927
IUPAC Name:
methyl 2-[[(4-chlorophenyl)methylideneamino]sulfamoyl]benzoate
InChI:
InChI=1S/C15H13ClN2O4S/c1-22-15(19)13-4-2-3-5-14(13)23(20,21)18-17-10-11-6-8-12(16)9-7-11/h2-10,18H,1H3
InChI Key:
XFMJBYXPGGYSNZ-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccccc1S(=O)(=O)NN=Cc1ccc(cc1)Cl
Properties
Complexity:
524
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
352.028g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
352.789g/mol
Monoisotopic Mass:
352.028g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
93.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3
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