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29573-38-4

29573-38-4 | Benzenesulfonic acid, 3-[2-[4-[2-(4-ethoxyphenyl)diazenyl]-1-naphthalenyl]diazenyl]-

CAS No: 29573-38-4 Catalog No: AG002YSW MDL No:

Product Description

Catalog Number:
AG002YSW
Chemical Name:
Benzenesulfonic acid, 3-[2-[4-[2-(4-ethoxyphenyl)diazenyl]-1-naphthalenyl]diazenyl]-
CAS Number:
29573-38-4
Molecular Formula:
C24H20N4O4S
Molecular Weight:
460.5050
IUPAC Name:
3-[[4-[(4-ethoxyphenyl)diazenyl]naphthalen-1-yl]diazenyl]benzenesulfonic acid
InChI:
InChI=1S/C24H20N4O4S/c1-2-32-19-12-10-17(11-13-19)25-27-23-14-15-24(22-9-4-3-8-21(22)23)28-26-18-6-5-7-20(16-18)33(29,30)31/h3-16H,2H2,1H3,(H,29,30,31)
InChI Key:
CDRDTGZOEUQSFA-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1)N=Nc1ccc(c2c1cccc2)N=Nc1cccc(c1)S(=O)(=O)O

Properties

Complexity:
776  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
460.121g/mol
Formal Charge:
0
Heavy Atom Count:
33  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
460.508g/mol
Monoisotopic Mass:
460.121g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
121A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.8  

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