Cas no 114969-60-7 (Pyrimidine, 5-chloro-4-methoxy-, 1-oxide)
114969-60-7 structure
Product Name:Pyrimidine, 5-chloro-4-methoxy-, 1-oxide
CAS No:114969-60-7
MF:C5H5ClN2O2
MW:160.558399915695
CID:3638009
PubChem ID:13860966
Update Time:2025-04-22
Pyrimidine, 5-chloro-4-methoxy-, 1-oxide Chemical and Physical Properties
Names and Identifiers
-
- Pyrimidine, 5-chloro-4-methoxy-, 1-oxide
- 5-Chloro-4-methoxy-pyrimidine 1-oxide
- 114969-60-7
- 5-Chloro-4-methoxypyrimidine 1-oxide
-
- Inchi： 1S/C5H5ClN2O2/c1-10-5-4(6)2-8(9)3-7-5/h2-3H,1H3
- InChI Key： KKDPTLLGGTWLKD-UHFFFAOYSA-N
- SMILES： C1[N+]([O-])=CC(Cl)=C(OC)N=1
Computed Properties
- Exact Mass: 160.0039551Da
- Monoisotopic Mass: 160.0039551Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 1
- Complexity: 114
- 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
- XLogP3: 0.1
- Topological Polar Surface Area: 47.6?2
Pyrimidine, 5-chloro-4-methoxy-, 1-oxide Related Literature
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
114969-60-7 (Pyrimidine, 5-chloro-4-methoxy-, 1-oxide) Related Products
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