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138683-66-6 | Pyrrolo[4,3,2-de]quinoline-7,8-dione, 1,3,4,5-tetrahydro-1,5-dimethyl-
CAS No: 138683-66-6 Catalog No: AG00190M MDL No:
Product Description
Catalog Number:
AG00190M
Chemical Name:
Pyrrolo[4,3,2-de]quinoline-7,8-dione, 1,3,4,5-tetrahydro-1,5-dimethyl-
CAS Number:
138683-66-6
Molecular Formula:
C12H12N2O2
Molecular Weight:
216.2359
IUPAC Name:
2,7-dimethyl-2,7-diazatricyclo[6.3.1.04,12]dodeca-1(12),3,8-triene-10,11-dione
InChI:
InChI=1S/C12H12N2O2/c1-13-4-3-7-6-14(2)11-10(7)8(13)5-9(15)12(11)16/h5-6H,3-4H2,1-2H3
InChI Key:
NWBAIJSXHACZNH-UHFFFAOYSA-N
SMILES:
CN1CCc2c3C1=CC(=O)C(=O)c3n(c2)C
NSC Number:
700003
Properties
Complexity:
402
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.09g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.24g/mol
Monoisotopic Mass:
216.09g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
42.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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