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Home > Nitro Compounds > 1807940-72-2
1807940-72-2 | 1-methyl-N-(4-nitrophenyl)-1,2-dihydropyridin-2-imine
CAS No: 1807940-72-2 Catalog No: AG01B1QB MDL No:
Product Description
Catalog Number:
AG01B1QB
Chemical Name:
1-methyl-N-(4-nitrophenyl)-1,2-dihydropyridin-2-imine
CAS Number:
1807940-72-2
Molecular Formula:
C12H11N3O2
Molecular Weight:
229.2346
IUPAC Name:
1-methyl-N-(4-nitrophenyl)pyridin-2-imine
InChI:
InChI=1S/C12H11N3O2/c1-14-9-3-2-4-12(14)13-10-5-7-11(8-6-10)15(16)17/h2-9H,1H3
InChI Key:
TVEVGRGTUZEPBQ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)N=c1ccccn1C
Properties
Complexity:
374
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.085g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.239g/mol
Monoisotopic Mass:
229.085g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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