Cas no 797052-90-5 (2,4,6-Pyridinetricarboxylic acid, tetrahydrate)
797052-90-5 structure
Product Name:2,4,6-Pyridinetricarboxylic acid, tetrahydrate
CAS No:797052-90-5
MF:C8H13NO10
MW:283.189523458481
CID:532174
PubChem ID:71402709
Update Time:2025-04-19
2,4,6-Pyridinetricarboxylic acid, tetrahydrate Chemical and Physical Properties
Names and Identifiers
-
- 2,4,6-Pyridinetricarboxylic acid, tetrahydrate
- pyridine-2,4,6-tricarboxylic acid,tetrahydrate
- 797052-90-5
- DTXSID10823666
- Pyridine-2,4,6-tricarboxylic acid--water (1/4)
-
- Inchi： 1S/C8H5NO6.4H2O/c10-6(11)3-1-4(7(12)13)9-5(2-3)8(14)15;;;;/h1-2H,(H,10,11)(H,12,13)(H,14,15);4*1H2
- InChI Key： VLCBXRVUOUTJOT-UHFFFAOYSA-N
- SMILES： OC(C1C=C(C(=O)O)N=C(C(=O)O)C=1)=O.O.O.O.O
Computed Properties
- Exact Mass: 283.05394561g/mol
- Monoisotopic Mass: 283.05394561g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 7
- Hydrogen Bond Acceptor Count: 11
- Heavy Atom Count: 19
- Rotatable Bond Count: 3
- Complexity: 280
- Covalently-Bonded Unit Count: 5
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 129?2
2,4,6-Pyridinetricarboxylic acid, tetrahydrate Related Literature
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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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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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
797052-90-5 (2,4,6-Pyridinetricarboxylic acid, tetrahydrate) Related Products
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- 207671-42-9(2,4-Pyridinedicarboxylic acid monohydrate)
- 915140-06-6(2-(hydroxymethyl)pyridine-4-carboxylic acid)
- 923169-37-3(4-(Hydroxymethyl)pyridine-2-carboxylic acid)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
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