Cas no 120717-41-1 (Pyrimidine,5-ethenyl-2-methoxy-)
120717-41-1 structure
Product Name:Pyrimidine,5-ethenyl-2-methoxy-
CAS No:120717-41-1
MF:C7H8N2O
MW:136.15122127533
CID:104935
PubChem ID:14148917
Update Time:2025-04-18
Pyrimidine,5-ethenyl-2-methoxy- Chemical and Physical Properties
Names and Identifiers
-
- Pyrimidine,5-ethenyl-2-methoxy-
- Pyrimidine, 5-ethenyl-2-methoxy- (9CI)
- 120717-41-1
- 5-ETHENYL-2-METHOXYPYRIMIDINE
- 2-Methoxy-5-vinylpyrimidine
- SCHEMBL2870003
- LIOOINKSXDJULD-UHFFFAOYSA-N
-
- Inchi： 1S/C7H8N2O/c1-3-6-4-8-7(10-2)9-5-6/h3-5H,1H2,2H3
- InChI Key： LIOOINKSXDJULD-UHFFFAOYSA-N
- SMILES： O(C)C1=NC=C(C=C)C=N1
Computed Properties
- Exact Mass: 136.06374
- Monoisotopic Mass: 136.063662883g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 2
- Complexity: 108
- 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,5-ethenyl-2-methoxy- Related Literature
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
-
A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
120717-41-1 (Pyrimidine,5-ethenyl-2-methoxy-) Related Products
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