Cas no 89216-64-8 (1,4-Benzenedicarboxylic acid, 2-(4-ethoxyphenoxy)-)
89216-64-8 structure
Product Name:1,4-Benzenedicarboxylic acid, 2-(4-ethoxyphenoxy)-
CAS No:89216-64-8
MF:C16H14O6
MW:302.278765201569
CID:608535
PubChem ID:19865560
Update Time:2025-04-19
1,4-Benzenedicarboxylic acid, 2-(4-ethoxyphenoxy)- Chemical and Physical Properties
Names and Identifiers
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- 1,4-Benzenedicarboxylic acid, 2-(4-ethoxyphenoxy)-
- 2-(4-ethoxyphenoxy)terephthalic acid
- DTXSID50600771
- SCHEMBL10452863
- 2-(4-Ethoxyphenoxy)benzene-1,4-dicarboxylic acid
- 89216-64-8
-
- Inchi： 1S/C16H14O6/c1-2-21-11-4-6-12(7-5-11)22-14-9-10(15(17)18)3-8-13(14)16(19)20/h3-9H,2H2,1H3,(H,17,18)(H,19,20)
- InChI Key： RPSVSVVEBCQMDN-UHFFFAOYSA-N
- SMILES： O(C1C=CC(=CC=1)OCC)C1C=C(C(=O)O)C=CC=1C(=O)O
Computed Properties
- Exact Mass: 302.07903816g/mol
- Monoisotopic Mass: 302.07903816g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 22
- Rotatable Bond Count: 6
- Complexity: 388
- 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: 2.7
- Topological Polar Surface Area: 93.1?2
1,4-Benzenedicarboxylic acid, 2-(4-ethoxyphenoxy)- Related Literature
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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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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Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
89216-64-8 (1,4-Benzenedicarboxylic acid, 2-(4-ethoxyphenoxy)-) Related Products
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