Cas no 110235-56-8 (Pyrimidine, 4-methyl-2-(methylsulfonyl)-6-(1-propynyl)-)
110235-56-8 structure
Product Name:Pyrimidine, 4-methyl-2-(methylsulfonyl)-6-(1-propynyl)-
CAS No:110235-56-8
MF:C9H10N2O2S
MW:210.252900600433
CID:1197032
Update Time:2024-08-05
Pyrimidine, 4-methyl-2-(methylsulfonyl)-6-(1-propynyl)- Chemical and Physical Properties
Names and Identifiers
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- Pyrimidine, 4-methyl-2-(methylsulfonyl)-6-(1-propynyl)-
- 2-methanesulfonyl-4-methyl-6-(1-propynyl)pyrimidine
- Pyrimidine, 4-methyl-2-(methylsulfonyl)-6-(1-propyn-1-yl)-
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- Inchi： 1S/C9H10N2O2S/c1-4-5-8-6-7(2)10-9(11-8)14(3,12)13/h6H,1-3H3
- InChI Key： VXYBWZGBBIVKIF-UHFFFAOYSA-N
- SMILES： C1(S(C)(=O)=O)=NC(C#CC)=CC(C)=N1
Computed Properties
- Exact Mass: 210.0464
Experimental Properties
- Density: 1.31±0.1 g/cm3(Predicted)
- Melting Point: 190-192 °C
- Boiling Point: 417.3±47.0 °C(Predicted)
- PSA: 59.92
- pka: -2.24±0.41(Predicted)
Pyrimidine, 4-methyl-2-(methylsulfonyl)-6-(1-propynyl)- Related Literature
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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