Cas no 25539-19-9 (1,4-Benzenedicarboxylic acid, 2-phenoxy-, dimethyl ester)
25539-19-9 structure
Product Name:1,4-Benzenedicarboxylic acid, 2-phenoxy-, dimethyl ester
CAS No:25539-19-9
MF:C16H14O5
MW:286.279365062714
CID:1423335
PubChem ID:23436153
Update Time:2025-04-20
1,4-Benzenedicarboxylic acid, 2-phenoxy-, dimethyl ester Chemical and Physical Properties
Names and Identifiers
-
- 1,4-Benzenedicarboxylic acid, 2-phenoxy-, dimethyl ester
- SCHEMBL490297
- DB-187105
- dimethyl phenoxyterephthalate
- 2-Phenoxy-terephthalic acid dimethyl ester
- 25539-19-9
- GQHAGXIGLCZUHY-UHFFFAOYSA-N
- Dimethyl 2-phenoxybenzene-1,4-dioate
-
- Inchi： 1S/C16H14O5/c1-19-15(17)11-8-9-13(16(18)20-2)14(10-11)21-12-6-4-3-5-7-12/h3-10H,1-2H3
- InChI Key： GQHAGXIGLCZUHY-UHFFFAOYSA-N
- SMILES： O(C1C=CC=CC=1)C1C=C(C(=O)OC)C=CC=1C(=O)OC
Computed Properties
- Exact Mass: 286.08412
- Monoisotopic Mass: 286.08412354g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 21
- Rotatable Bond Count: 6
- Complexity: 362
- 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: 3.2
- Topological Polar Surface Area: 61.8?2
Experimental Properties
- PSA: 61.83
1,4-Benzenedicarboxylic acid, 2-phenoxy-, dimethyl ester Related Literature
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Jason Wan Lab Chip, 2020,20, 4528-4538
25539-19-9 (1,4-Benzenedicarboxylic acid, 2-phenoxy-, dimethyl ester) Related Products
- 2150-46-1(Methyl 2,5-dihydroxybenzoate)
- 4670-56-8(Methyl 4-Methylsalicylate)
- 5446-02-6(Methyl 4-methoxysalicylate)
- 22955-73-3(Dimethyl 4-methoxyisophthalate)
- 552-94-3(Salsalate)
- 606-45-1(Methyl 2-methoxybenzoate)
- 2065-27-2(Methyl 2,6-dimethoxybenzoate)
- 6342-70-7(Methyl 2-Hydroxy-3-methoxybenzoate)
- 3686-55-3(Methyl 2-ethoxybenzoate)
- 118-55-8(Phenyl salicylate)
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