Cas no 650622-15-4 (1,2,4,5-Cyclohexanetetracarboxylic acid, 3,6-dimethyl-)
650622-15-4 structure
Product Name:1,2,4,5-Cyclohexanetetracarboxylic acid, 3,6-dimethyl-
CAS No:650622-15-4
MF:C12H16O8
MW:288.250644683838
CID:408597
PubChem ID:20449000
Update Time:2025-04-19
1,2,4,5-Cyclohexanetetracarboxylic acid, 3,6-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- 1,2,4,5-Cyclohexanetetracarboxylic acid, 3,6-dimethyl-
- 3,6-dimethylcyclohexane-1,2,4,5-tetracarboxylic acid
- 650622-15-4
- DTXSID50607301
- SCHEMBL11049187
-
- Inchi： 1S/C12H16O8/c1-3-5(9(13)14)7(11(17)18)4(2)8(12(19)20)6(3)10(15)16/h3-8H,1-2H3,(H,13,14)(H,15,16)(H,17,18)(H,19,20)
- InChI Key： KCJZRMCALPKDJU-UHFFFAOYSA-N
- SMILES： OC(C1C(C(=O)O)C(C)C(C(=O)O)C(C(=O)O)C1C)=O
Computed Properties
- Exact Mass: 288.08448
- Monoisotopic Mass: 288.08451746g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 20
- Rotatable Bond Count: 4
- Complexity: 374
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 4
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -0.3
- Topological Polar Surface Area: 149?2
Experimental Properties
- PSA: 149.2
1,2,4,5-Cyclohexanetetracarboxylic acid, 3,6-dimethyl- Related Literature
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
650622-15-4 (1,2,4,5-Cyclohexanetetracarboxylic acid, 3,6-dimethyl-) Related Products
- 610-09-3(cis-1,2-Cyclohexanedicarboxylic acid)
- 874-61-3(4-oxocyclohexane-1-carboxylic acid)
- 619-81-8(Cis-1,2-Cyclohexanedicarboxylic Acid)
- 97-61-0(2-Methyl-pentanoic Acid)
- 88-09-5(2-Ethylbutyric acid)
- 498-21-5(Methylsuccinic acid)
- 681-57-2(2,2-Dimethylglutaric acid)
- 619-82-9(trans-cyclohexane-1,4-dicarboxylic acid)
- 828-51-3(Adamantane-1-carboxylic acid)
- 99-66-1(Valproic acid)
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