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Home > Pyridines > 1404375-16-1
1404375-16-1 | 4-Methylbenzenesulfonate; (1-methylpyridin-1-ium-2-yl)hydrazine
CAS No: 1404375-16-1 Catalog No: AG00HVVG MDL No:MFCD09832907
Product Description
Catalog Number:
AG00HVVG
Chemical Name:
4-Methylbenzenesulfonate; (1-methylpyridin-1-ium-2-yl)hydrazine
CAS Number:
1404375-16-1
Molecular Formula:
C13H17N3O3S
Molecular Weight:
295.3574
MDL Number:
MFCD09832907
IUPAC Name:
4-methylbenzenesulfonate;(1-methylpyridin-1-ium-2-yl)hydrazine
InChI:
InChI=1S/C7H8O3S.C6H9N3/c1-6-2-4-7(5-3-6)11(8,9)10;1-9-5-3-2-4-6(9)8-7/h2-5H,1H3,(H,8,9,10);2-5H,7H2,1H3
InChI Key:
BTSNOXLIZKNPEP-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)[O-].NNc1cccc[n+]1C
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.099g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
295.357g/mol
Monoisotopic Mass:
295.099g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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