Cas no 744253-38-1 (Ethyl 6-chloro-5-ethyl-2-methylpyrimidine-4-carboxylate)
744253-38-1 structure
Product Name:Ethyl 6-chloro-5-ethyl-2-methylpyrimidine-4-carboxylate
CAS No:744253-38-1
MF:C10H13ClN2O2
MW:228.675421476364
CID:2190682
PubChem ID:59488665
Update Time:2025-04-21
Ethyl 6-chloro-5-ethyl-2-methylpyrimidine-4-carboxylate Chemical and Physical Properties
Names and Identifiers
-
- Ethyl 6-chloro-5-ethyl-2-methylpyrimidine-4-carboxylate
- SCHEMBL1705589
- 744253-38-1
- DB-308065
-
- Inchi： 1S/C10H13ClN2O2/c1-4-7-8(10(14)15-5-2)12-6(3)13-9(7)11/h4-5H2,1-3H3
- InChI Key： JBLIXYLFJIEOJJ-UHFFFAOYSA-N
- SMILES： ClC1=C(C(C(=O)OCC)=NC(C)=N1)CC
Computed Properties
- Exact Mass: 228.067
- Monoisotopic Mass: 228.067
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 4
- Complexity: 226
- 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
- Topological Polar Surface Area: 52.1A^2
- XLogP3: 2.9
Ethyl 6-chloro-5-ethyl-2-methylpyrimidine-4-carboxylate Related Literature
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
744253-38-1 (Ethyl 6-chloro-5-ethyl-2-methylpyrimidine-4-carboxylate) Related Products
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