Cas no 2166-27-0 (3,6-Pyridazinedicarboxylic acid, 4-phenyl-, dimethyl ester)
2166-27-0 structure
Product Name:3,6-Pyridazinedicarboxylic acid, 4-phenyl-, dimethyl ester
CAS No:2166-27-0
MF:C14H12N2O4
MW:272.256083488464
CID:1408920
Update Time:2024-08-15
3,6-Pyridazinedicarboxylic acid, 4-phenyl-, dimethyl ester Chemical and Physical Properties
Names and Identifiers
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- 3,6-Pyridazinedicarboxylic acid, 4-phenyl-, dimethyl ester
- 3,6-Pyridazinedicarboxylic acid, 4-phenyl-, 3,6-dimethyl ester
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- Inchi: 1S/C14H12N2O4/c1-19-13(17)11-8-10(9-6-4-3-5-7-9)12(16-15-11)14(18)20-2/h3-8H,1-2H3
- InChI Key: KHUCKSJRPBKMDE-UHFFFAOYSA-N
- SMILES: C1(C(OC)=O)=NN=C(C(OC)=O)C=C1C1=CC=CC=C1
Computed Properties
- Exact Mass: 272.07976
Experimental Properties
- Density: 1.254±0.06 g/cm3(Predicted)
- Melting Point: 94.0-95.5 °C
- Boiling Point: 498.7±45.0 °C(Predicted)
- PSA: 78.38
- pka: -1.56±0.10(Predicted)
3,6-Pyridazinedicarboxylic acid, 4-phenyl-, dimethyl ester Related Literature
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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