Cas no 101581-08-2 (6-chloro-8-iodo-4(3H)-Quinazolinone)
101581-08-2 structure
Product Name:6-chloro-8-iodo-4(3H)-Quinazolinone
CAS No:101581-08-2
MF:C8H4ClIN2O
MW:306.487632751465
CID:2115363
Update Time:2023-11-19
6-chloro-8-iodo-4(3H)-Quinazolinone Chemical and Physical Properties
Names and Identifiers
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- 6-chloro-8-iodo-4(3H)-Quinazolinone
- LVLQEQAIIKLAFB-UHFFFAOYSA-N
- 6-chloro-8-iodo-3H-quinazolin-4-one
- 4(3H)-Quinazolinone, 6-chloro-8-iodo-
- CID 136344378
-
- Inchi： 1S/C8H4ClIN2O/c9-4-1-5-7(6(10)2-4)11-3-12-8(5)13/h1-3H,(H,11,12,13)
- InChI Key： LVLQEQAIIKLAFB-UHFFFAOYSA-N
- SMILES： IC1=CC(=CC2C(NC=NC=21)=O)Cl
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 0
- Complexity: 259
- Topological Polar Surface Area: 41.5
6-chloro-8-iodo-4(3H)-Quinazolinone Related Literature
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J. M. Granadino-Roldán,M. Fernández-Gómez,A. Navarro,T. Pe?a Ruiz,U. A. Jayasooriya Phys. Chem. Chem. Phys., 2004,6, 1133-1143
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
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Michael Kappl,Paul M. Young,Daniela Traini,Sanyog Jain RSC Adv., 2016,6, 25789-25798
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