Cas no 916685-12-6 (Pyrimidine, 5-(2,6-dimethylphenyl)-)
916685-12-6 structure
Product Name:Pyrimidine, 5-(2,6-dimethylphenyl)-
CAS No:916685-12-6
MF:C12H12N2
MW:184.237082481384
CID:1966611
PubChem ID:53423909
Update Time:2025-04-21
Pyrimidine, 5-(2,6-dimethylphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Pyrimidine, 5-(2,6-dimethylphenyl)-
- 5-(2,6-dimethylphenyl)pyrimidine
- 916685-12-6
- DTXSID90698410
-
- Inchi： 1S/C12H12N2/c1-9-4-3-5-10(2)12(9)11-6-13-8-14-7-11/h3-8H,1-2H3
- InChI Key： ISSUVNQHOHBSSP-UHFFFAOYSA-N
- SMILES： N1C=NC=C(C=1)C1C(C)=CC=CC=1C
Computed Properties
- Exact Mass: 184.1
- Monoisotopic Mass: 184.1
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- 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
- Topological Polar Surface Area: 25.8A^2
- XLogP3: 2.6
Pyrimidine, 5-(2,6-dimethylphenyl)- Related Literature
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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4. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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