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Home > Indoles and Oxindole > 59615-75-7
59615-75-7 | 7-Methyl-5-oxo-2-phenyl-3,5-dihydro-indolizine-6-carbonitrile
CAS No: 59615-75-7 Catalog No: AG01F2H9 MDL No:
Product Description
Catalog Number:
AG01F2H9
Chemical Name:
7-Methyl-5-oxo-2-phenyl-3,5-dihydro-indolizine-6-carbonitrile
CAS Number:
59615-75-7
Molecular Formula:
C16H12N2O
Molecular Weight:
248.2793
IUPAC Name:
7-methyl-5-oxo-2-phenyl-3H-indolizine-6-carbonitrile
InChI:
InChI=1S/C16H12N2O/c1-11-7-14-8-13(12-5-3-2-4-6-12)10-18(14)16(19)15(11)9-17/h2-8H,10H2,1H3
InChI Key:
YLSWSSCRJOUHEH-UHFFFAOYSA-N
SMILES:
N#Cc1c(C)cc2n(c1=O)CC(=C2)c1ccccc1
Properties
Complexity:
565
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.095g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
248.285g/mol
Monoisotopic Mass:
248.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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