Cas no 62095-43-6 (Acetic acid, (4-methylphenoxy)-, 4-chlorophenyl ester)
62095-43-6 structure
Product Name:Acetic acid, (4-methylphenoxy)-, 4-chlorophenyl ester
CAS No:62095-43-6
MF:C15H13ClO3
MW:276.714923620224
CID:458353
PubChem ID:805581
Update Time:2025-04-19
Acetic acid, (4-methylphenoxy)-, 4-chlorophenyl ester Chemical and Physical Properties
Names and Identifiers
-
- Acetic acid, (4-methylphenoxy)-, 4-chlorophenyl ester
- (4-chlorophenyl) 2-(4-methylphenoxy)acetate
- 62095-43-6
- AKOS002163340
- 4-chlorophenyl (4-methylphenoxy)acetate
- DTXSID30355550
-
- Inchi： 1S/C15H13ClO3/c1-11-2-6-13(7-3-11)18-10-15(17)19-14-8-4-12(16)5-9-14/h2-9H,10H2,1H3
- InChI Key： KARQJTWJAWARLW-UHFFFAOYSA-N
- SMILES： ClC1C=CC(=CC=1)OC(COC1C=CC(C)=CC=1)=O
Computed Properties
- Exact Mass: 276.05539
- Monoisotopic Mass: 276.0553220g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 19
- Rotatable Bond Count: 5
- Complexity: 279
- 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: 4.4
- Topological Polar Surface Area: 35.5?2
Experimental Properties
- PSA: 35.53
Acetic acid, (4-methylphenoxy)-, 4-chlorophenyl ester Related Literature
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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