Cas no 87425-59-0 (Acetic acid, 2,2'-[(5-methyl-1,3-phenylene)bis(oxy)]bis-)
87425-59-0 structure
Product Name:Acetic acid, 2,2'-[(5-methyl-1,3-phenylene)bis(oxy)]bis-
CAS No:87425-59-0
MF:C11H12O6
MW:240.209383964539
CID:656467
PubChem ID:3626972
Update Time:2025-04-19
Acetic acid, 2,2'-[(5-methyl-1,3-phenylene)bis(oxy)]bis- Chemical and Physical Properties
Names and Identifiers
-
- Acetic acid, 2,2'-[(5-methyl-1,3-phenylene)bis(oxy)]bis-
- 2-[3-(carboxymethoxy)-5-methylphenoxy]acetic acid
- DTXSID80394439
- SCHEMBL5387851
- 87425-59-0
-
- Inchi: 1S/C11H12O6/c1-7-2-8(16-5-10(12)13)4-9(3-7)17-6-11(14)15/h2-4H,5-6H2,1H3,(H,12,13)(H,14,15)
- InChI Key: UOBAJSWXHKDRKK-UHFFFAOYSA-N
- SMILES: O(CC(=O)O)C1C=C(C=C(C)C=1)OCC(=O)O
Computed Properties
- Exact Mass: 240.06338810g/mol
- Monoisotopic Mass: 240.06338810g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 17
- Rotatable Bond Count: 6
- Complexity: 251
- 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: 1.6
- Topological Polar Surface Area: 93.1?2
Acetic acid, 2,2'-[(5-methyl-1,3-phenylene)bis(oxy)]bis- Related Literature
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
87425-59-0 (Acetic acid, 2,2'-[(5-methyl-1,3-phenylene)bis(oxy)]bis-) Related Products
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