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6268-49-1 | 4-((4-(Dimethylamino);phenyl);diazenyl);benzoic acid
CAS No: 6268-49-1 Catalog No: AG003LAL MDL No:MFCD00058988
Product Description
Catalog Number:
AG003LAL
Chemical Name:
4-((4-(Dimethylamino);phenyl);diazenyl);benzoic acid
CAS Number:
6268-49-1
Molecular Formula:
C15H15N3O2
Molecular Weight:
269.2985
MDL Number:
MFCD00058988
IUPAC Name:
4-[[4-(dimethylamino)phenyl]diazenyl]benzoic acid
InChI:
InChI=1S/C15H15N3O2/c1-18(2)14-9-7-13(8-10-14)17-16-12-5-3-11(4-6-12)15(19)20/h3-10H,1-2H3,(H,19,20)
InChI Key:
WCKQPPQRFNHPRJ-UHFFFAOYSA-N
SMILES:
CN(c1ccc(cc1)/N=N/c1ccc(cc1)C(=O)O)C
NSC Number:
36265
Properties
Complexity:
341
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.116g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
269.304g/mol
Monoisotopic Mass:
269.116g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
65.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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