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143966-93-2 | 1-Triazene, 1,3-bis(4-methylphenyl)-, 1-oxide (9CI)
CAS No: 143966-93-2 Catalog No: AG001IOG MDL No:
Product Description
Catalog Number:
AG001IOG
Chemical Name:
1-Triazene, 1,3-bis(4-methylphenyl)-, 1-oxide (9CI)
CAS Number:
143966-93-2
Molecular Formula:
C14H15N3O
Molecular Weight:
241.2884
IUPAC Name:
(4-methylphenyl)-[(4-methylphenyl)hydrazinylidene]-oxidoazanium
InChI:
InChI=1S/C14H15N3O/c1-11-3-7-13(8-4-11)15-16-17(18)14-9-5-12(2)6-10-14/h3-10,15H,1-2H3
InChI Key:
CQENKDBZOSKINQ-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)NN=[N+](c1ccc(cc1)C)[O-]
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.122g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
241.294g/mol
Monoisotopic Mass:
241.122g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.2
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