Cas no 3451-02-3 (1,2,3,4-benzenetetracarboxylic acid, tetramethyl ester)
3451-02-3 structure
Product Name:1,2,3,4-benzenetetracarboxylic acid, tetramethyl ester
CAS No:3451-02-3
MF:C14H14O8
MW:310.256165027618
CID:919275
PubChem ID:520689
Update Time:2025-04-19
1,2,3,4-benzenetetracarboxylic acid, tetramethyl ester Chemical and Physical Properties
Names and Identifiers
-
- 1,2,3,4-benzenetetracarboxylic acid, tetramethyl ester
- 3451-02-3
- Tetramethyl 1,2,3,4-benzenetetracarboxylate #
- DTXSID10334429
- AKOS000276817
- tetramethyl benzenetetracarboxylate
- QDJPGDCRLZYJGQ-UHFFFAOYSA-N
- Tetramethyl 1,2,3,4-benzenetetracarboxylate
- SCHEMBL11348001
-
- Inchi： 1S/C14H14O8/c1-19-11(15)7-5-6-8(12(16)20-2)10(14(18)22-4)9(7)13(17)21-3/h5-6H,1-4H3
- InChI Key： QDJPGDCRLZYJGQ-UHFFFAOYSA-N
- SMILES： O(C)C(C1C(C(=O)OC)=CC=C(C(=O)OC)C=1C(=O)OC)=O
Computed Properties
- Exact Mass: 310.06882
- Monoisotopic Mass: 310.06886740g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 22
- Rotatable Bond Count: 8
- Complexity: 416
- 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: 1.3
- Topological Polar Surface Area: 105?2
Experimental Properties
- PSA: 105.2
1,2,3,4-benzenetetracarboxylic acid, tetramethyl ester Related Literature
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Kathrin Kutlescha,Rhett Kempe New J. Chem., 2010,34, 1954-1960
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J. M. Granadino-Roldán,M. Fernández-Gómez,A. Navarro,T. Pe?a Ruiz,U. A. Jayasooriya Phys. Chem. Chem. Phys., 2004,6, 1133-1143
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
3451-02-3 (1,2,3,4-benzenetetracarboxylic acid, tetramethyl ester) Related Products
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