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928119-98-6 | 2H-Benzo[a]quinolizin-2-one, 3-acetyl-1,6,7,11b-tetrahydro-4-methyl-
CAS No: 928119-98-6 Catalog No: AG006DAR MDL No:
Product Description
Catalog Number:
AG006DAR
Chemical Name:
2H-Benzo[a]quinolizin-2-one, 3-acetyl-1,6,7,11b-tetrahydro-4-methyl-
CAS Number:
928119-98-6
Molecular Formula:
C16H17NO2
Molecular Weight:
255.3117
IUPAC Name:
3-acetyl-4-methyl-1,6,7,11b-tetrahydrobenzo[a]quinolizin-2-one
InChI:
InChI=1S/C16H17NO2/c1-10-16(11(2)18)15(19)9-14-13-6-4-3-5-12(13)7-8-17(10)14/h3-6,14H,7-9H2,1-2H3
InChI Key:
KYJRGUBYPFREAH-UHFFFAOYSA-N
SMILES:
O=C1CC2N(C(=C1C(=O)C)C)CCc1c2cccc1
Properties
Complexity:
452
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.126g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
255.317g/mol
Monoisotopic Mass:
255.126g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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