Cas no 617716-36-6 (Pyrimidine, 4,6-dichloro-5-methyl-2-(2-methylcyclopropyl)-)
617716-36-6 structure
Product Name:Pyrimidine, 4,6-dichloro-5-methyl-2-(2-methylcyclopropyl)-
CAS No:617716-36-6
MF:C9H10Cl2N2
MW:217.095099925995
CID:4070302
PubChem ID:10307972
Update Time:2025-04-22
Pyrimidine, 4,6-dichloro-5-methyl-2-(2-methylcyclopropyl)- Chemical and Physical Properties
Names and Identifiers
-
- Pyrimidine, 4,6-dichloro-5-methyl-2-(2-methylcyclopropyl)-
- SCHEMBL4425825
- DB-194876
- AKOS014755797
- 4,6-dichloro-5-methyl-2-(2-methylcyclopropyl)pyrimidine
- 617716-36-6
-
- Inchi： 1S/C9H10Cl2N2/c1-4-3-6(4)9-12-7(10)5(2)8(11)13-9/h4,6H,3H2,1-2H3
- InChI Key： VSDWYAQTXQMGMT-UHFFFAOYSA-N
- SMILES： C1(C2CC2C)=NC(Cl)=C(C)C(Cl)=N1
Computed Properties
- Exact Mass: 216.0221037Da
- Monoisotopic Mass: 216.0221037Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 188
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.5
- Topological Polar Surface Area: 25.8?2
Pyrimidine, 4,6-dichloro-5-methyl-2-(2-methylcyclopropyl)- Related Literature
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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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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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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