Cas no 61623-61-8 (Methyl 2-(2-(2-oxoethyl)phenyl)acetate)
61623-61-8 structure
Product Name:Methyl 2-(2-(2-oxoethyl)phenyl)acetate
CAS No:61623-61-8
MF:C11H12O3
MW:192.211183547974
CID:472435
PubChem ID:12241424
Update Time:2025-04-19
Methyl 2-(2-(2-oxoethyl)phenyl)acetate Chemical and Physical Properties
Names and Identifiers
-
- Methyl 2-(2-(2-oxoethyl)phenyl)acetate
- methyl 2-[2-(2-oxoethyl)phenyl]acetate
- Methyl [2-(2-oxoethyl)phenyl]acetate
- 61623-61-8
- DTXSID50482019
-
- Inchi： 1S/C11H12O3/c1-14-11(13)8-10-5-3-2-4-9(10)6-7-12/h2-5,7H,6,8H2,1H3
- InChI Key： RDCORGLLNDVGII-UHFFFAOYSA-N
- SMILES： O(C)C(CC1C=CC=CC=1CC=O)=O
Computed Properties
- Exact Mass: 192.07866
- Monoisotopic Mass: 192.078644241g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 5
- Complexity: 201
- 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: 1.1
- Topological Polar Surface Area: 43.4?2
Experimental Properties
- PSA: 43.37
Methyl 2-(2-(2-oxoethyl)phenyl)acetate Related Literature
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Kevin M. Koo,Abu Ali Ibn Sina,Laura G. Carrascosa,Muhammad J. A. Shiddiky Analyst, 2014,139, 6178-6184
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Riccardo Spezia,Stefan Knecht,Benedetta Mennucci Phys. Chem. Chem. Phys., 2017,19, 17156-17166
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C. Achilli,G. F. Guidetti,A. Ciana,D. Capsoni,G. Minetti Biomater. Sci., 2016,4, 1417-1421
61623-61-8 (Methyl 2-(2-(2-oxoethyl)phenyl)acetate) Related Products
- 5460-08-2(Ethyl mesitylacetate)
- 41841-19-4(Benzeneacetic acid, 2,4,6-triMethyl-, Methyl ester)
- 23786-13-2(Methyl 4-Methylphenylacetate)
- 101-41-7(Methyl phenylacetate)
- 40291-39-2(Ethyl o-tolylacetate)
- 40851-62-5(Methyl 2-(2-Methylphenyl)acetate)
- 53088-69-0(Methyl 2-(m-tolyl)acetate)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
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