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130552-90-8 | (E)-N-benzylidenebenzenesulfonaMide
CAS No: 130552-90-8 Catalog No: AG009Z24 MDL No:MFCD00011587
Product Description
Catalog Number:
AG009Z24
Chemical Name:
(E)-N-benzylidenebenzenesulfonaMide
CAS Number:
130552-90-8
Molecular Formula:
C13H11NO2S
Molecular Weight:
245.2969
MDL Number:
MFCD00011587
IUPAC Name:
(NE)-N-benzylidenebenzenesulfonamide
InChI:
InChI=1S/C13H11NO2S/c15-17(16,13-9-5-2-6-10-13)14-11-12-7-3-1-4-8-12/h1-11H/b14-11+
InChI Key:
MPNRJEPBAYEQBY-SDNWHVSQSA-N
SMILES:
O=S(=O)(c1ccccc1)/N=C/c1ccccc1
Properties
Complexity:
344
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
245.051g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
245.296g/mol
Monoisotopic Mass:
245.051g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
54.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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