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16675-74-4 | 9H-1,3-Benzodioxolo[5,6-b]quinolizin-9-one, 5,7,8,10,10a,11-hexahydro-
CAS No: 16675-74-4 Catalog No: AG001WXA MDL No:
Product Description
Catalog Number:
AG001WXA
Chemical Name:
9H-1,3-Benzodioxolo[5,6-b]quinolizin-9-one, 5,7,8,10,10a,11-hexahydro-
CAS Number:
16675-74-4
Molecular Formula:
C14H15NO3
Molecular Weight:
245.2738
IUPAC Name:
5,7,8,10,10a,11-hexahydro-[1,3]benzodioxolo[6,5-b]quinolizin-9-one
InChI:
InChI=1S/C14H15NO3/c16-12-1-2-15-7-10-5-14-13(17-8-18-14)4-9(10)3-11(15)6-12/h4-5,11H,1-3,6-8H2
InChI Key:
VFQITYZWHSOFHY-UHFFFAOYSA-N
SMILES:
O=C1CCN2C(C1)Cc1c(C2)cc2c(c1)OCO2
NSC Number:
131696
Properties
Complexity:
359
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.105g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
245.278g/mol
Monoisotopic Mass:
245.105g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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