Cas no 306960-81-6 (4-Pyrimidinecarbonylchloride, 2-chloro-6-methyl-)
306960-81-6 structure
Product Name:4-Pyrimidinecarbonylchloride, 2-chloro-6-methyl-
CAS No:306960-81-6
MF:C6H4Cl2N2O
MW:191.014759063721
CID:300317
PubChem ID:10726366
Update Time:2025-04-19
4-Pyrimidinecarbonylchloride, 2-chloro-6-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 4-Pyrimidinecarbonylchloride, 2-chloro-6-methyl-
- 4-Pyrimidinecarbonyl chloride, 2-chloro-6-methyl- (9CI)
- 2-chloro-6-methylpyrimidine-4-carbonyl chloride
- 306960-81-6
- DTXSID60443979
- 2-CHLORO-6-METHYL-4-PYRIMIDINECARBONYL CHLORIDE
- 2-chloro-6-methylpyrimidine-4-carbonylchloride
- NVIQIDGSHAKRLP-UHFFFAOYSA-N
- AKOS006309520
- SCHEMBL3055010
-
- Inchi： 1S/C6H4Cl2N2O/c1-3-2-4(5(7)11)10-6(8)9-3/h2H,1H3
- InChI Key： NVIQIDGSHAKRLP-UHFFFAOYSA-N
- SMILES： ClC1=NC(C(=O)Cl)=CC(C)=N1
Computed Properties
- Exact Mass: 189.97022
- Monoisotopic Mass: 189.9700681g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 165
- 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: 2.4
- Topological Polar Surface Area: 42.8?2
Experimental Properties
- PSA: 42.85
4-Pyrimidinecarbonylchloride, 2-chloro-6-methyl- Related Literature
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
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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
-
Bruce Parkinson Energy Environ. Sci., 2010,3, 509-511
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Zhizhen Lai,Mo Zhang,Jinyu Zhou,Tianjing Chen,Dan Li,Xuejing Shen,Jia Liu,Jiang Zhou,Zhili Li Analyst, 2021,146, 4261-4267
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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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