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919286-78-5 | 5H-Cyclohepta[c]quinoline-6,9-dione, 10,11-dihydro-5-methyl-
CAS No: 919286-78-5 Catalog No: AG006JX9 MDL No:
Product Description
Catalog Number:
AG006JX9
Chemical Name:
5H-Cyclohepta[c]quinoline-6,9-dione, 10,11-dihydro-5-methyl-
CAS Number:
919286-78-5
Molecular Formula:
C15H13NO2
Molecular Weight:
239.2692
IUPAC Name:
5-methyl-10,11-dihydrocyclohepta[c]quinoline-6,9-dione
InChI:
InChI=1S/C15H13NO2/c1-16-14-5-3-2-4-12(14)11-8-6-10(17)7-9-13(11)15(16)18/h2-5,7,9H,6,8H2,1H3
InChI Key:
UKRJXQOPMHTTCW-UHFFFAOYSA-N
SMILES:
O=C1CCc2c(C=C1)c(=O)n(c1c2cccc1)C
Properties
Complexity:
461
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.095g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.274g/mol
Monoisotopic Mass:
239.095g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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