Cas no 1357079-87-8 (Methyl 4-chloro-2-(trifluoromethyl)quinazoline-8-carboxylate)
1357079-87-8 structure
Product Name:Methyl 4-chloro-2-(trifluoromethyl)quinazoline-8-carboxylate
CAS No:1357079-87-8
MF:C11H6ClF3N2O2
MW:290.625751972198
CID:2126768
Update Time:2023-08-04
Methyl 4-chloro-2-(trifluoromethyl)quinazoline-8-carboxylate Chemical and Physical Properties
Names and Identifiers
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- methyl 4-chloro-2-(trifluoromethyl)quinazoline-8-carboxylate
- Methyl 4-chloro-2-(trifluoromethyl)quinazoline-8-carboxylate
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- Inchi： 1S/C11H6ClF3N2O2/c1-19-9(18)6-4-2-3-5-7(6)16-10(11(13,14)15)17-8(5)12/h2-4H,1H3
- InChI Key： RZNRNMRVRXKNDK-UHFFFAOYSA-N
- SMILES： ClC1=C2C=CC=C(C(=O)OC)C2=NC(C(F)(F)F)=N1
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 19
- Rotatable Bond Count: 2
- Complexity: 353
- Topological Polar Surface Area: 52.1
Methyl 4-chloro-2-(trifluoromethyl)quinazoline-8-carboxylate Related Literature
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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4. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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