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126299-26-1 | Butanamide, 2-[2-(3-hydroxyphenyl)diazenyl]-3-oxo-N-phenyl-
CAS No: 126299-26-1 Catalog No: AG000SIJ MDL No:
Product Description
Catalog Number:
AG000SIJ
Chemical Name:
Butanamide, 2-[2-(3-hydroxyphenyl)diazenyl]-3-oxo-N-phenyl-
CAS Number:
126299-26-1
Molecular Formula:
C16H15N3O3
Molecular Weight:
297.3086
IUPAC Name:
2-[(3-hydroxyphenyl)diazenyl]-3-oxo-N-phenylbutanamide
InChI:
InChI=1S/C16H15N3O3/c1-11(20)15(16(22)17-12-6-3-2-4-7-12)19-18-13-8-5-9-14(21)10-13/h2-10,15,21H,1H3,(H,17,22)
InChI Key:
IRUQWKFIUYJYFS-UHFFFAOYSA-N
SMILES:
Oc1cccc(c1)N=NC(C(=O)Nc1ccccc1)C(=O)C
Properties
Complexity:
419
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.111g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
297.314g/mol
Monoisotopic Mass:
297.111g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
91.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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