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88429-10-1 | 1-Naphthalenesulfonamide, 6-diazo-5,6-dihydro-N,N-dimethyl-5-oxo-
CAS No: 88429-10-1 Catalog No: AG004ESB MDL No:
Product Description
Catalog Number:
AG004ESB
Chemical Name:
1-Naphthalenesulfonamide, 6-diazo-5,6-dihydro-N,N-dimethyl-5-oxo-
CAS Number:
88429-10-1
Molecular Formula:
C12H11N3O3S
Molecular Weight:
277.2990
IUPAC Name:
2-diazonio-5-(dimethylsulfamoyl)naphthalen-1-olate
InChI:
InChI=1S/C12H11N3O3S/c1-15(2)19(17,18)11-5-3-4-9-8(11)6-7-10(14-13)12(9)16/h3-7H,1-2H3
InChI Key:
BMNLTDCWKYHPBT-UHFFFAOYSA-N
SMILES:
[N-]=[N+]=C1C=Cc2c(C1=O)cccc2S(=O)(=O)N(C)C
Properties
Complexity:
476
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.052g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
277.298g/mol
Monoisotopic Mass:
277.052g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
97A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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