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Home > Indoles and Oxindole > 917966-85-9
917966-85-9 | 1H-Indole, 1-methyl-2-(3-nitro-2-pyridinyl)-
CAS No: 917966-85-9 Catalog No: AG006AKZ MDL No:
Product Description
Catalog Number:
AG006AKZ
Chemical Name:
1H-Indole, 1-methyl-2-(3-nitro-2-pyridinyl)-
CAS Number:
917966-85-9
Molecular Formula:
C14H11N3O2
Molecular Weight:
253.2560
IUPAC Name:
1-methyl-2-(3-nitropyridin-2-yl)indole
InChI:
InChI=1S/C14H11N3O2/c1-16-11-6-3-2-5-10(11)9-13(16)14-12(17(18)19)7-4-8-15-14/h2-9H,1H3
InChI Key:
VIYZPFZLAVFFRO-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccnc1c1cc2c(n1C)cccc2
Properties
Complexity:
344
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.085g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
253.261g/mol
Monoisotopic Mass:
253.085g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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