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2475-43-6 | Benzenamine, 2-methoxy-5-methyl-4-[2-(4-nitrophenyl)diazenyl]-
CAS No: 2475-43-6 Catalog No: AG002PBN MDL No:
Product Description
Catalog Number:
AG002PBN
Chemical Name:
Benzenamine, 2-methoxy-5-methyl-4-[2-(4-nitrophenyl)diazenyl]-
CAS Number:
2475-43-6
Molecular Formula:
C14H14N4O3
Molecular Weight:
286.2860
IUPAC Name:
2-methoxy-5-methyl-4-[(4-nitrophenyl)diazenyl]aniline
InChI:
InChI=1S/C14H14N4O3/c1-9-7-12(15)14(21-2)8-13(9)17-16-10-3-5-11(6-4-10)18(19)20/h3-8H,15H2,1-2H3
InChI Key:
TUSSBGHDSRBBFW-UHFFFAOYSA-N
SMILES:
COc1cc(N=Nc2ccc(cc2)[N+](=O)[O-])c(cc1N)C
EC Number:
219-601-6
Properties
Complexity:
377
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.107g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
286.291g/mol
Monoisotopic Mass:
286.107g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
106A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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