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138683-68-8 | Pyrrolo[4,3,2-de]quinoline-7,8-dione, 1,3,4,5-tetrahydro-1-methyl-
CAS No: 138683-68-8 Catalog No: AG00190L MDL No:
Product Description
Catalog Number:
AG00190L
Chemical Name:
Pyrrolo[4,3,2-de]quinoline-7,8-dione, 1,3,4,5-tetrahydro-1-methyl-
CAS Number:
138683-68-8
Molecular Formula:
C11H10N2O2
Molecular Weight:
202.2093
IUPAC Name:
2-methyl-2,7-diazatricyclo[6.3.1.04,12]dodeca-1(12),3,8-triene-10,11-dione
InChI:
InChI=1S/C11H10N2O2/c1-13-5-6-2-3-12-7-4-8(14)11(15)10(13)9(6)7/h4-5,12H,2-3H2,1H3
InChI Key:
GVAJEQQAYYNXFL-UHFFFAOYSA-N
SMILES:
O=C1C=C2NCCc3c2c(C1=O)n(C)c3
NSC Number:
741158
Properties
Complexity:
375
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.074g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
202.213g/mol
Monoisotopic Mass:
202.074g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
51.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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