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Home > Pyridines > 114226-44-7
114226-44-7 | 1H-Indeno[2,1-c]pyridine, 2,3,4,9-tetrahydro-2-methyl-9-phenyl-, nitrate (1:1)
CAS No: 114226-44-7 Catalog No: AG000AWB MDL No:
Product Description
Catalog Number:
AG000AWB
Chemical Name:
1H-Indeno[2,1-c]pyridine, 2,3,4,9-tetrahydro-2-methyl-9-phenyl-, nitrate (1:1)
CAS Number:
114226-44-7
Molecular Formula:
C19H20N2O3
Molecular Weight:
324.3737
IUPAC Name:
2-methyl-9-phenyl-1,3,4,9-tetrahydroindeno[2,1-c]pyridine;nitric acid
InChI:
InChI=1S/C19H19N.HNO3/c1-20-12-11-16-15-9-5-6-10-17(15)19(18(16)13-20)14-7-3-2-4-8-14;2-1(3)4/h2-10,19H,11-13H2,1H3;(H,2,3,4)
InChI Key:
VNPBUNUBQYZEKS-UHFFFAOYSA-N
SMILES:
CN1CCC2=C(C1)C(c1ccccc1)c1c2cccc1.[O-][N+](=O)O
Properties
Complexity:
415
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.147g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
324.38g/mol
Monoisotopic Mass:
324.147g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
69.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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