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621-90-9 | N-Methyl-4-(phenyldiazenyl);aniline
CAS No: 621-90-9 Catalog No: AG003K90 MDL No:MFCD00059198
Product Description
Catalog Number:
AG003K90
Chemical Name:
N-Methyl-4-(phenyldiazenyl);aniline
CAS Number:
621-90-9
Molecular Formula:
C13H13N3
Molecular Weight:
211.2624
MDL Number:
MFCD00059198
IUPAC Name:
N-methyl-4-phenyldiazenylaniline
InChI:
InChI=1S/C13H13N3/c1-14-11-7-9-13(10-8-11)16-15-12-5-3-2-4-6-12/h2-10,14H,1H3
InChI Key:
DKOXITJAUZNAPK-UHFFFAOYSA-N
SMILES:
CNc1ccc(cc1)/N=N/c1ccccc1
UNII:
44N974BFDI
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.111g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
211.268g/mol
Monoisotopic Mass:
211.111g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
36.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
Literature
| Title | Journal |
|---|---|
| N-oxidation of aromatic amines by intracellular oxidases. | Drug metabolism reviews 20020801 |
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