Cas no 80109-86-0 (4,6-Pyrimidinedicarboxaldehyde, 2-phenyl-)
80109-86-0 structure
Product Name:4,6-Pyrimidinedicarboxaldehyde, 2-phenyl-
CAS No:80109-86-0
MF:C12H8N2O2
MW:212.204122543335
CID:583638
PubChem ID:12735799
Update Time:2025-04-19
4,6-Pyrimidinedicarboxaldehyde, 2-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- 4,6-Pyrimidinedicarboxaldehyde, 2-phenyl-
- 2-phenylpyrimidine-4,6-dicarbaldehyde
- SCHEMBL302424
- 80109-86-0
- DTXSID40508494
-
- Inchi： 1S/C12H8N2O2/c15-7-10-6-11(8-16)14-12(13-10)9-4-2-1-3-5-9/h1-8H
- InChI Key： KIBPCGYMWCKMNL-UHFFFAOYSA-N
- SMILES： O=CC1=CC(C=O)=NC(C2C=CC=CC=2)=N1
Computed Properties
- Exact Mass: 212.058577502g/mol
- Monoisotopic Mass: 212.058577502g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 3
- Complexity: 235
- 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: 1.8
- Topological Polar Surface Area: 59.9?2
4,6-Pyrimidinedicarboxaldehyde, 2-phenyl- Related Literature
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
80109-86-0 (4,6-Pyrimidinedicarboxaldehyde, 2-phenyl-) Related Products
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- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
- 89640-58-4(2-Iodo-4-nitrophenylhydrazine)
- 1449132-38-0(3-Fluoro-5-(2-fluoro-5-methylbenzylcarbamoyl)benzeneboronic acid)
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