Cas no 66875-59-0 (3,5-Pyridinedicarboxylic acid, 1,2-dihydro-1-methyl-, dimethyl ester)
66875-59-0 structure
Product Name:3,5-Pyridinedicarboxylic acid, 1,2-dihydro-1-methyl-, dimethyl ester
CAS No:66875-59-0
MF:C10H13NO4
MW:211.214523077011
CID:1713054
PubChem ID:71374966
Update Time:2025-04-21
3,5-Pyridinedicarboxylic acid, 1,2-dihydro-1-methyl-, dimethyl ester Chemical and Physical Properties
Names and Identifiers
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- 3,5-Pyridinedicarboxylic acid, 1,2-dihydro-1-methyl-, dimethyl ester
- dimethyl 1-methyl-2H-pyridine-3,5-dicarboxylate
- Dimethyl 1-methyl-1,2-dihydropyridine-3,5-dicarboxylate
- 66875-59-0
- DTXSID00797721
-
- Inchi: 1S/C10H13NO4/c1-11-5-7(9(12)14-2)4-8(6-11)10(13)15-3/h4-5H,6H2,1-3H3
- InChI Key: CPZQJEXKNNNBPR-UHFFFAOYSA-N
- SMILES: O(C)C(C1=CC(C(=O)OC)=CN(C)C1)=O
Computed Properties
- Exact Mass: 211.08449
- Monoisotopic Mass: 211.08445790g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 15
- Rotatable Bond Count: 4
- Complexity: 343
- 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: 0.4
- Topological Polar Surface Area: 55.8?2
Experimental Properties
- PSA: 55.84
3,5-Pyridinedicarboxylic acid, 1,2-dihydro-1-methyl-, dimethyl ester Related Literature
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1. 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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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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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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