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83848-83-3 | 4H-Imidazo[4,5,1-ij]quinolin-2(1H)-one
CAS No: 83848-83-3 Catalog No: AG008HUZ MDL No:
Product Description
Catalog Number:
AG008HUZ
Chemical Name:
4H-Imidazo[4,5,1-ij]quinolin-2(1H)-one
CAS Number:
83848-83-3
Molecular Formula:
C10H8N2O
Molecular Weight:
172.1833
IUPAC Name:
1,3-diazatricyclo[6.3.1.04,12]dodeca-4,6,8(12),9-tetraen-2-one
InChI:
InChI=1S/C10H8N2O/c13-10-11-8-5-1-3-7-4-2-6-12(10)9(7)8/h1-5H,6H2,(H,11,13)
InChI Key:
QBRFYQULBWCTPB-UHFFFAOYSA-N
SMILES:
O=c1[nH]c2c3n1CC=Cc3ccc2
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.064g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
172.187g/mol
Monoisotopic Mass:
172.064g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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