Cas no 924638-59-5 (Ethanone, 1-(4,8-dimethyl-3-cinnolinyl)-)
924638-59-5 structure
Product Name:Ethanone, 1-(4,8-dimethyl-3-cinnolinyl)-
CAS No:924638-59-5
MF:C12H12N2O
MW:200.236482620239
CID:2815081
PubChem ID:11842804
Update Time:2025-04-21
Ethanone, 1-(4,8-dimethyl-3-cinnolinyl)- Chemical and Physical Properties
Names and Identifiers
-
- Ethanone, 1-(4,8-dimethyl-3-cinnolinyl)-
- 924638-59-5
- DTXSID20474289
- DTXCID50425103
-
- Inchi： 1S/C12H12N2O/c1-7-5-4-6-10-8(2)12(9(3)15)14-13-11(7)10/h4-6H,1-3H3
- InChI Key： YSJQWTWAOSUTRF-UHFFFAOYSA-N
- SMILES： O=C(C)C1=C(C)C2C=CC=C(C)C=2N=N1
Computed Properties
- Exact Mass: 200.094963011g/mol
- Monoisotopic Mass: 200.094963011g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 1
- Complexity: 254
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.9
- Topological Polar Surface Area: 42.8?2
Ethanone, 1-(4,8-dimethyl-3-cinnolinyl)- Related Literature
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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