Cas no 879608-76-1 (4-(4-tert-butylphenyl)-2,6-dichloropyrimidine)
879608-76-1 structure
Product Name:4-(4-tert-butylphenyl)-2,6-dichloropyrimidine
CAS No:879608-76-1
MF:C14H14Cl2N2
MW:281.180361270905
CID:2123632
PubChem ID:22135526
Update Time:2025-04-21
4-(4-tert-butylphenyl)-2,6-dichloropyrimidine Chemical and Physical Properties
Names and Identifiers
-
- 4-(4-tert-butylphenyl)-2,6-dichloropyrimidine
- DA-01712
- 879608-76-1
- SCHEMBL1012956
- AKOS015052464
-
- Inchi： 1S/C14H14Cl2N2/c1-14(2,3)10-6-4-9(5-7-10)11-8-12(15)18-13(16)17-11/h4-8H,1-3H3
- InChI Key： GLUXZHRKJLLXRI-UHFFFAOYSA-N
- SMILES： ClC1=CC(C2C=CC(=CC=2)C(C)(C)C)=NC(=N1)Cl
Computed Properties
- Exact Mass: 280.0534038Da
- Monoisotopic Mass: 280.0534038Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 18
- Rotatable Bond Count: 2
- Complexity: 269
- 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: 5.5
- Topological Polar Surface Area: 25.8?2
4-(4-tert-butylphenyl)-2,6-dichloropyrimidine Related Literature
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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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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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
879608-76-1 (4-(4-tert-butylphenyl)-2,6-dichloropyrimidine) Related Products
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