Cas no 146533-38-2 (PYRIMIDINE, 4,6-DICHLORO-5-(3,4-DIMETHOXYPHENYL)-)
146533-38-2 structure
Product Name:PYRIMIDINE, 4,6-DICHLORO-5-(3,4-DIMETHOXYPHENYL)-
CAS No:146533-38-2
MF:C12H10Cl2N2O2
MW:285.126000881195
CID:3521637
PubChem ID:19735464
Update Time:2025-04-21
PYRIMIDINE, 4,6-DICHLORO-5-(3,4-DIMETHOXYPHENYL)- Chemical and Physical Properties
Names and Identifiers
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- PYRIMIDINE, 4,6-DICHLORO-5-(3,4-DIMETHOXYPHENYL)-
- SCHEMBL9047349
- 4,6-dichloro-5-(3,4-dimethoxyphenyl)pyrimidine
- 146533-38-2
- DTXSID901248836
-
- Inchi： 1S/C12H10Cl2N2O2/c1-17-8-4-3-7(5-9(8)18-2)10-11(13)15-6-16-12(10)14/h3-6H,1-2H3
- InChI Key： QSHMQFLDDQVVBK-UHFFFAOYSA-N
- SMILES： C1=NC(Cl)=C(C2=CC=C(OC)C(OC)=C2)C(Cl)=N1
Computed Properties
- Exact Mass: 284.012
- Monoisotopic Mass: 284.012
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 18
- Rotatable Bond Count: 3
- Complexity: 261
- 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: 44.2A^2
- XLogP3: 3.7
PYRIMIDINE, 4,6-DICHLORO-5-(3,4-DIMETHOXYPHENYL)- Related Literature
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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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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
146533-38-2 (PYRIMIDINE, 4,6-DICHLORO-5-(3,4-DIMETHOXYPHENYL)-) Related Products
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