Home Sulfos N'1-(4-nitrobenzylidene)-4-methylbenzene-1-sulfonohydrazide

N'1-(4-nitrobenzylidene)-4-methylbenzene-1-sulfonohydrazide

CAS No.:
1747-50-8
Catalog Number:
AG01CAIH
Molecular Formula:
C14H13N3O4S
Molecular Weight:
319.3357
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Product Description
Catalog Number:
AG01CAIH
Chemical Name:
N'1-(4-nitrobenzylidene)-4-methylbenzene-1-sulfonohydrazide
CAS Number:
1747-50-8
Molecular Formula:
C14H13N3O4S
Molecular Weight:
319.3357
MDL Number:
MFCD00115922
IUPAC Name:
4-methyl-N-[(4-nitrophenyl)methylideneamino]benzenesulfonamide
InChI:
InChI=1S/C14H13N3O4S/c1-11-2-8-14(9-3-11)22(20,21)16-15-10-12-4-6-13(7-5-12)17(18)19/h2-10,16H,1H3
InChI Key:
WIZQIGJXWBUJMH-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)N/N=C/c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
493  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.063g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
319.335g/mol
Monoisotopic Mass:
319.063g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
2.7  
Properties