Cas no 61776-73-6 (Propanoic acid, 2-phenoxy-, carboxymethyl ester)
61776-73-6 structure
Product Name:Propanoic acid, 2-phenoxy-, carboxymethyl ester
CAS No:61776-73-6
MF:C11H12O5
MW:224.209983825684
CID:390726
PubChem ID:71373947
Update Time:2025-04-19
Propanoic acid, 2-phenoxy-, carboxymethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Propanoic acid, 2-phenoxy-, carboxymethyl ester
- 2-(2-phenoxypropanoyloxy)acetic acid
- DTXSID60796750
- 61776-73-6
- [(2-Phenoxypropanoyl)oxy]acetic acid
-
- Inchi： 1S/C11H12O5/c1-8(11(14)15-7-10(12)13)16-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,12,13)
- InChI Key： NEPFYQOCRSCOSR-UHFFFAOYSA-N
- SMILES： O(C1C=CC=CC=1)C(C(=O)OCC(=O)O)C
Computed Properties
- Exact Mass: 224.06847348g/mol
- Monoisotopic Mass: 224.06847348g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 16
- Rotatable Bond Count: 6
- Complexity: 245
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.8
- Topological Polar Surface Area: 72.8?2
Propanoic acid, 2-phenoxy-, carboxymethyl ester Related Literature
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
61776-73-6 (Propanoic acid, 2-phenoxy-, carboxymethyl ester) Related Products
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- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
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