Cas no 656822-35-4 (Pyrimidine, 2,4-dichloro-6-(3-methylbutyl)-)
656822-35-4 structure
Product Name:Pyrimidine, 2,4-dichloro-6-(3-methylbutyl)-
CAS No:656822-35-4
MF:C9H12Cl2N2
MW:219.110980033875
CID:1700101
Update Time:2024-09-02
Pyrimidine, 2,4-dichloro-6-(3-methylbutyl)- Chemical and Physical Properties
Names and Identifiers
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- Pyrimidine, 2,4-dichloro-6-(3-methylbutyl)-
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- Inchi： 1S/C9H12Cl2N2/c1-6(2)3-4-7-5-8(10)13-9(11)12-7/h5-6H,3-4H2,1-2H3
- InChI Key： AKJREQZTJYZRCO-UHFFFAOYSA-N
- SMILES： C1(Cl)=NC(CCC(C)C)=CC(Cl)=N1
Computed Properties
- Exact Mass: 218.03796
Experimental Properties
- Density: 1.200±0.06 g/cm3(Predicted)
- Boiling Point: 287.9±20.0 °C(Predicted)
- PSA: 25.78
- pka: -2.21±0.32(Predicted)
Pyrimidine, 2,4-dichloro-6-(3-methylbutyl)- Related Literature
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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Nduka Ikpo,Jenna C. Flogeras,Francesca M. Kerton Dalton Trans., 2013,42, 8998-9006
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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