Cas no 261-01-8 (Pyrimido[4,5-b]quinoline(8CI,9CI))
![Pyrimido[4,5-b]quinoline(8CI,9CI) structure](https://ossimg.kuujia.com/scimg/500/261-01-8x500.png)
261-01-8 structure
Product Name:Pyrimido[4,5-b]quinoline(8CI,9CI)
CAS No:261-01-8
MF:C11H7N3
MW:181.193381547928
CID:266438
PubChem ID:18187322
Update Time:2025-04-19
Pyrimido[4,5-b]quinoline(8CI,9CI) Chemical and Physical Properties
Names and Identifiers
-
- Pyrimido[4,5-b]quinoline(8CI,9CI)
- 2,4-Diazaacridine
- pyrimido[4,5-b]quinoline
- SCHEMBL3261625
- 261-01-8
- DTXSID70592689
-
- Inchi： 1S/C11H7N3/c1-2-4-10-8(3-1)5-9-6-12-7-13-11(9)14-10/h1-7H
- InChI Key： LTIAEPYUMKCFJZ-UHFFFAOYSA-N
- SMILES： N1C2C(=CN=CN=2)C=C2C=CC=CC=12
Computed Properties
- Exact Mass: 181.06411
- Monoisotopic Mass: 181.063997236g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 0
- Complexity: 207
- 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: 2.1
- Topological Polar Surface Area: 38.7?2
Experimental Properties
- PSA: 38.67
Pyrimido[4,5-b]quinoline(8CI,9CI) Related Literature
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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Jason Wan Lab Chip, 2020,20, 4528-4538
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