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125183-56-4 | Benzenesulfonic acid, 2-(dimethylamino)-5-[2-(3-sulfophenyl)diazenyl]-
CAS No: 125183-56-4 Catalog No: AG000NBF MDL No:
Product Description
Catalog Number:
AG000NBF
Chemical Name:
Benzenesulfonic acid, 2-(dimethylamino)-5-[2-(3-sulfophenyl)diazenyl]-
CAS Number:
125183-56-4
Molecular Formula:
C14H15N3O6S2
Molecular Weight:
385.4154
IUPAC Name:
2-(dimethylamino)-5-[(3-sulfophenyl)diazenyl]benzenesulfonic acid
InChI:
InChI=1S/C14H15N3O6S2/c1-17(2)13-7-6-11(9-14(13)25(21,22)23)16-15-10-4-3-5-12(8-10)24(18,19)20/h3-9H,1-2H3,(H,18,19,20)(H,21,22,23)
InChI Key:
RWICZRNYIFPZJK-UHFFFAOYSA-N
SMILES:
CN(c1ccc(cc1S(=O)(=O)O)N=Nc1cccc(c1)S(=O)(=O)O)C
Properties
Complexity:
680
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
385.04g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
385.409g/mol
Monoisotopic Mass:
385.04g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
154A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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