Cas no 947762-31-4 (2-Pyrimidinamine, 4-(4-aminophenyl)-6-chloro-)
947762-31-4 structure
Product Name:2-Pyrimidinamine, 4-(4-aminophenyl)-6-chloro-
CAS No:947762-31-4
MF:C10H9ClN4
MW:220.65826010704
CID:2106536
Update Time:2023-08-03
2-Pyrimidinamine, 4-(4-aminophenyl)-6-chloro- Chemical and Physical Properties
Names and Identifiers
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- 4-(4-aminophenyl)-6-chloro-2-Pyrimidinamine
- 2-Pyrimidinamine, 4-(4-aminophenyl)-6-chloro-
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- Inchi： 1S/C10H9ClN4/c11-9-5-8(14-10(13)15-9)6-1-3-7(12)4-2-6/h1-5H,12H2,(H2,13,14,15)
- InChI Key： BNDDUKPFNDSZGR-UHFFFAOYSA-N
- SMILES： ClC1=CC(C2C=CC(=CC=2)N)=NC(N)=N1
Computed Properties
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 1
- Complexity: 206
- Topological Polar Surface Area: 77.8
2-Pyrimidinamine, 4-(4-aminophenyl)-6-chloro- Related Literature
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
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