Cas no 131124-93-1 (Acetic acid, [2-(acetyloxy)phenoxy]-)
131124-93-1 structure
Product Name:Acetic acid, [2-(acetyloxy)phenoxy]-
CAS No:131124-93-1
MF:C10H10O5
MW:210.183403491974
CID:1227478
PubChem ID:14886405
Update Time:2025-04-20
Acetic acid, [2-(acetyloxy)phenoxy]- Chemical and Physical Properties
Names and Identifiers
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- Acetic acid, [2-(acetyloxy)phenoxy]-
- 2-(2-acetyloxyphenoxy)acetic acid
- 2-acetoxyphenoxyacetic acid
- SCHEMBL12986383
- DTXSID20565005
- 131124-93-1
- [2-(Acetyloxy)phenoxy]acetic acid
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- Inchi: 1S/C10H10O5/c1-7(11)15-9-5-3-2-4-8(9)14-6-10(12)13/h2-5H,6H2,1H3,(H,12,13)
- InChI Key: ZYBHHSSQGPZIBR-UHFFFAOYSA-N
- SMILES: O(CC(=O)O)C1C=CC=CC=1OC(C)=O
Computed Properties
- Exact Mass: 210.05282342g/mol
- Monoisotopic Mass: 210.05282342g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 15
- Rotatable Bond Count: 5
- Complexity: 238
- 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: 0.8
- Topological Polar Surface Area: 72.8?2
Acetic acid, [2-(acetyloxy)phenoxy]- Related Literature
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
131124-93-1 (Acetic acid, [2-(acetyloxy)phenoxy]-) Related Products
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