Cas no 112451-49-7 (Pyrimidine, 4-chloro-6-methyl-2-(6-propyl-2-pyridinyl)-)
112451-49-7 structure
Product Name:Pyrimidine, 4-chloro-6-methyl-2-(6-propyl-2-pyridinyl)-
CAS No:112451-49-7
MF:C13H14ClN3
MW:247.723361492157
CID:1200331
Update Time:2024-08-04
Pyrimidine, 4-chloro-6-methyl-2-(6-propyl-2-pyridinyl)- Chemical and Physical Properties
Names and Identifiers
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- Pyrimidine, 4-chloro-6-methyl-2-(6-propyl-2-pyridinyl)-
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- Inchi： 1S/C13H14ClN3/c1-3-5-10-6-4-7-11(16-10)13-15-9(2)8-12(14)17-13/h4,6-8H,3,5H2,1-2H3
- InChI Key： OCWWLSXFZXLZTR-UHFFFAOYSA-N
- SMILES： C1(C2=NC(CCC)=CC=C2)=NC(C)=CC(Cl)=N1
Computed Properties
- Exact Mass: 247.08782
Experimental Properties
- Density: 1.168±0.06 g/cm3(Predicted)
- Melting Point: 77.1 °C
- Boiling Point: 299.1±32.0 °C(Predicted)
- PSA: 38.67
- pka: 1.12±0.19(Predicted)
Pyrimidine, 4-chloro-6-methyl-2-(6-propyl-2-pyridinyl)- Related Literature
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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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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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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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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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