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34021-21-1 | 5,6,6a,7-Tetrahydro-6-methyl-4H-benzo[de][1,3]benzodioxolo[5,6-g]quinoline
CAS No: 34021-21-1 Catalog No: AG00CPXA MDL No:
Product Description
Catalog Number:
AG00CPXA
Chemical Name:
5,6,6a,7-Tetrahydro-6-methyl-4H-benzo[de][1,3]benzodioxolo[5,6-g]quinoline
CAS Number:
34021-21-1
IUPAC Name:
13-methyl-5,7-dioxa-13-azapentacyclo[10.7.1.02,10.04,8.016,20]icosa-1(19),2,4(8),9,16(20),17-hexaene
InChI:
InChI=1S/C18H17NO2/c1-19-6-5-11-3-2-4-13-14-9-17-16(20-10-21-17)8-12(14)7-15(19)18(11)13/h2-4,8-9,15H,5-7,10H2,1H3
InChI Key:
KBPOKWUORZNIRX-UHFFFAOYSA-N
Properties
Complexity:
414
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.126g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
279.339g/mol
Monoisotopic Mass:
279.126g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
21.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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