Cas no 389606-20-6 (5-Pyrimidinecarbonitrile, 2-chloro-4-(diethylamino)-)
389606-20-6 structure
Product Name:5-Pyrimidinecarbonitrile, 2-chloro-4-(diethylamino)-
CAS No:389606-20-6
MF:C9H11ClN4
MW:210.66343998909
CID:1496666
Update Time:2024-08-24
5-Pyrimidinecarbonitrile, 2-chloro-4-(diethylamino)- Chemical and Physical Properties
Names and Identifiers
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- 5-Pyrimidinecarbonitrile, 2-chloro-4-(diethylamino)-
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- Inchi： 1S/C9H11ClN4/c1-3-14(4-2)8-7(5-11)6-12-9(10)13-8/h6H,3-4H2,1-2H3
- InChI Key： GUFAICNCBOVCFK-UHFFFAOYSA-N
- SMILES： C1(Cl)=NC=C(C#N)C(N(CC)CC)=N1
Computed Properties
- Exact Mass: 210.06743
Experimental Properties
- Density: 1.24±0.1 g/cm3(Predicted)
- Boiling Point: 387.9±27.0 °C(Predicted)
- PSA: 52.81
- pka: 0.46±0.10(Predicted)
5-Pyrimidinecarbonitrile, 2-chloro-4-(diethylamino)- Related Literature
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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Zhizhen Lai,Mo Zhang,Jinyu Zhou,Tianjing Chen,Dan Li,Xuejing Shen,Jia Liu,Jiang Zhou,Zhili Li Analyst, 2021,146, 4261-4267
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
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