Cas no 54127-92-3 (Pyrimidine, 2-chloro-5-(2-methoxyethyl)-)
54127-92-3 structure
Product Name:Pyrimidine, 2-chloro-5-(2-methoxyethyl)-
CAS No:54127-92-3
MF:C7H9ClN2O
MW:172.61216044426
CID:355388
PubChem ID:20483412
Update Time:2025-04-19
Pyrimidine, 2-chloro-5-(2-methoxyethyl)- Chemical and Physical Properties
Names and Identifiers
-
- Pyrimidine, 2-chloro-5-(2-methoxyethyl)-
- 2-chloro-5-(2-methoxyethyl)pyrimidine
- DTXSID10607847
- 54127-92-3
- SCHEMBL11145787
-
- Inchi： 1S/C7H9ClN2O/c1-11-3-2-6-4-9-7(8)10-5-6/h4-5H,2-3H2,1H3
- InChI Key： UENWVFNBHFTLHK-UHFFFAOYSA-N
- SMILES： ClC1=NC=C(C=N1)CCOC
Computed Properties
- Exact Mass: 172.04047
- Monoisotopic Mass: 172.0403406g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 3
- Complexity: 105
- 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: 1.3
- Topological Polar Surface Area: 35?2
Experimental Properties
- PSA: 35.01
Pyrimidine, 2-chloro-5-(2-methoxyethyl)- Related Literature
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
-
Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
54127-92-3 (Pyrimidine, 2-chloro-5-(2-methoxyethyl)-) Related Products
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