Cas no 14496-63-0 (Propionic acid,2-(p-chlorophenoxy)-2-methyl-, ethylene ester (8CI))
14496-63-0 structure
Product Name:Propionic acid,2-(p-chlorophenoxy)-2-methyl-, ethylene ester (8CI)
CAS No:14496-63-0
MF:C22H24Cl2O6
MW:455.328365325928
CID:154488
PubChem ID:203458
Update Time:2025-04-19
Propionic acid,2-(p-chlorophenoxy)-2-methyl-, ethylene ester (8CI) Chemical and Physical Properties
Names and Identifiers
-
- Propionic acid,2-(p-chlorophenoxy)-2-methyl-, ethylene ester (8CI)
- 2-[2-(4-chlorophenoxy)-2-methylpropanoyl]oxyethyl 2-(4-chlorophenoxy)-2-methylpropanoate
- Ethylenebis[2-(4-chlorophenoxy)-2-methylpropionate]
- 14496-63-0
- DTXSID20162851
- Propionic acid, 2-(p-chlorophenoxy)-2-methyl-, 1,2-ethandiyl ester
- 1,2-Ethanediyl bis(alpha-(p-chlorophenoxy)isobutyrate)
- BRN 1897015
-
- Inchi： 1S/C22H24Cl2O6/c1-21(2,29-17-9-5-15(23)6-10-17)19(25)27-13-14-28-20(26)22(3,4)30-18-11-7-16(24)8-12-18/h5-12H,13-14H2,1-4H3
- InChI Key： SOTYXLLMVQKIQB-UHFFFAOYSA-N
- SMILES： ClC1C=CC(=CC=1)OC(C(=O)OCCOC(C(C)(C)OC1C=CC(=CC=1)Cl)=O)(C)C
Computed Properties
- Exact Mass: 454.09512
- Monoisotopic Mass: 454.0949939g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 30
- Rotatable Bond Count: 11
- Complexity: 514
- 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: 5.8
- Topological Polar Surface Area: 71.1?2
Experimental Properties
- PSA: 71.06
Propionic acid,2-(p-chlorophenoxy)-2-methyl-, ethylene ester (8CI) Related Literature
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J. M. Granadino-Roldán,M. Fernández-Gómez,A. Navarro,T. Pe?a Ruiz,U. A. Jayasooriya Phys. Chem. Chem. Phys., 2004,6, 1133-1143
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Connor J. Taylor,Hikaru Seki,Friederike M. Dannheim,Mark J. Willis,Graeme Clemens,Brian A. Taylor,Thomas W. Chamberlain,Richard A. Bourne React. Chem. Eng., 2021,6, 1404-1411
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Raktani Bikshapathi,Sai Prathima Parvathaneni,Vaidya Jayathirtha Rao Green Chem., 2017,19, 4446-4450
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Kui Wu,Zhihua Yang,Shilie Pan Dalton Trans., 2015,44, 19856-19864
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