Cas no 922169-89-9 (Acetic acid, 2-[4-[bis(4-hydroxy-2,5-dimethylphenyl)methyl]phenoxy]-)
922169-89-9 structure
Product Name:Acetic acid, 2-[4-[bis(4-hydroxy-2,5-dimethylphenyl)methyl]phenoxy]-
CAS No:922169-89-9
MF:C25H26O5
MW:406.470947742462
CID:741797
PubChem ID:71421689
Update Time:2025-04-19
Acetic acid, 2-[4-[bis(4-hydroxy-2,5-dimethylphenyl)methyl]phenoxy]- Chemical and Physical Properties
Names and Identifiers
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- Acetic acid, 2-[4-[bis(4-hydroxy-2,5-dimethylphenyl)methyl]phenoxy]-
- 2-[4-[bis(4-hydroxy-2,5-dimethylphenyl)methyl]phenoxy]acetic acid
- {4-[Bis(4-hydroxy-2,5-dimethylphenyl)methyl]phenoxy}acetic acid
- DTXSID30840739
- 922169-89-9
-
- Inchi: 1S/C25H26O5/c1-14-11-22(26)16(3)9-20(14)25(21-10-17(4)23(27)12-15(21)2)18-5-7-19(8-6-18)30-13-24(28)29/h5-12,25-27H,13H2,1-4H3,(H,28,29)
- InChI Key: QARXBGUJNWEXFQ-UHFFFAOYSA-N
- SMILES: OC1=CC(C)=C(C=C1C)C(C1C=CC(=CC=1)OCC(=O)O)C1C=C(C)C(=CC=1C)O
Computed Properties
- Exact Mass: 406.17802393g/mol
- Monoisotopic Mass: 406.17802393g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 30
- Rotatable Bond Count: 6
- Complexity: 528
- 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: 5.6
- Topological Polar Surface Area: 87?2
Acetic acid, 2-[4-[bis(4-hydroxy-2,5-dimethylphenyl)methyl]phenoxy]- Related Literature
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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