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Home > Nitro Compounds > 77446-51-6
77446-51-6 | 9H-Indeno[2,1-b]pyridine, 7-nitro-
CAS No: 77446-51-6 Catalog No: AG0053FH MDL No:
Product Description
Catalog Number:
AG0053FH
Chemical Name:
9H-Indeno[2,1-b]pyridine, 7-nitro-
CAS Number:
77446-51-6
Molecular Formula:
C12H8N2O2
Molecular Weight:
212.2041
IUPAC Name:
7-nitro-9H-indeno[2,1-b]pyridine
InChI:
InChI=1S/C12H8N2O2/c15-14(16)9-3-4-10-8(6-9)7-12-11(10)2-1-5-13-12/h1-6H,7H2
InChI Key:
BYMLCFMGXFVMTK-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc2c(c1)Cc1c2cccn1
Properties
Complexity:
289
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.059g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.208g/mol
Monoisotopic Mass:
212.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
58.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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