Cas no 64958-55-0 (Pyrimidine,2-(1-methoxy-1-methylethyl)-)
64958-55-0 structure
Product Name:Pyrimidine,2-(1-methoxy-1-methylethyl)-
CAS No:64958-55-0
MF:C8H12N2O
MW:152.193681716919
CID:501290
PubChem ID:12440910
Update Time:2025-04-19
Pyrimidine,2-(1-methoxy-1-methylethyl)- Chemical and Physical Properties
Names and Identifiers
-
- Pyrimidine,2-(1-methoxy-1-methylethyl)-
- Pyrimidine, 2-(1-methoxy-1-methylethyl)- (9CI)
- 2-(2-methoxypropan-2-yl)pyrimidine
- SCHEMBL20560461
- 64958-55-0
-
- Inchi： 1S/C8H12N2O/c1-8(2,11-3)7-9-5-4-6-10-7/h4-6H,1-3H3
- InChI Key： CDFLIPBXXMXWPR-UHFFFAOYSA-N
- SMILES： O(C)C(C1N=CC=CN=1)(C)C
Computed Properties
- Exact Mass: 152.09506
- Monoisotopic Mass: 152.094963011g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 119
- 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: 0.5
- Topological Polar Surface Area: 35?2
Experimental Properties
- PSA: 35.01
Pyrimidine,2-(1-methoxy-1-methylethyl)- Related Literature
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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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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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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