Cas no 67829-86-1 (Acetic acid, (2,4-dichlorophenoxy)-, 2-methylphenyl ester)
67829-86-1 structure
Product Name:Acetic acid, (2,4-dichlorophenoxy)-, 2-methylphenyl ester
CAS No:67829-86-1
MF:C15H12Cl2O3
MW:311.159982681274
CID:394052
PubChem ID:675636
Update Time:2025-04-19
Acetic acid, (2,4-dichlorophenoxy)-, 2-methylphenyl ester Chemical and Physical Properties
Names and Identifiers
-
- Acetic acid, (2,4-dichlorophenoxy)-, 2-methylphenyl ester
- (2-methylphenyl) 2-(2,4-dichlorophenoxy)acetate
- ST054563
- Oprea1_833934
- 67829-86-1
- Oprea1_442914
- AKOS000491058
- 2-methylphenyl (2,4-dichlorophenoxy)acetate
- CBMicro_047734
- BIM-0047807.P001
- DTXSID50350209
-
- Inchi： 1S/C15H12Cl2O3/c1-10-4-2-3-5-13(10)20-15(18)9-19-14-7-6-11(16)8-12(14)17/h2-8H,9H2,1H3
- InChI Key： ZCMHOGZDHOCCSA-UHFFFAOYSA-N
- SMILES： ClC1C=C(C=CC=1OCC(=O)OC1C=CC=CC=1C)Cl
Computed Properties
- Exact Mass: 310.01646
- Monoisotopic Mass: 310.0163496g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 20
- Rotatable Bond Count: 5
- Complexity: 324
- 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
- Topological Polar Surface Area: 35.5?2
Experimental Properties
- PSA: 35.53
Acetic acid, (2,4-dichlorophenoxy)-, 2-methylphenyl ester Related Literature
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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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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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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