Cas no 25201-35-8 (Ethanone,1-(2,3,4,5,6-pentachlorophenyl)-)
25201-35-8 structure
Product Name:Ethanone,1-(2,3,4,5,6-pentachlorophenyl)-
CAS No:25201-35-8
MF:C8H3Cl5O
MW:292.373817682266
CID:264353
PubChem ID:32836
Update Time:2025-04-19
Ethanone,1-(2,3,4,5,6-pentachlorophenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Ethanone,1-(2,3,4,5,6-pentachlorophenyl)-
- Pentachloroacetophenone
- 1-(2,3,4,5,6-pentachlorophenyl)ethanone
- ACETOPHENONE, 2',3',4',5',6'-PENTACHLORO-
- BRN 1970874
- 1-(Pentachlorophenyl)ethanone
- 25201-35-8
- Ethanone, 1-(pentachlorophenyl)-
- DTXSID20921460
- 1-(Pentachlorophenyl)ethan-1-one
- 4-07-00-00646 (Beilstein Handbook Reference)
-
- Inchi： 1S/C8H3Cl5O/c1-2(14)3-4(9)6(11)8(13)7(12)5(3)10/h1H3
- InChI Key： HPWXYMIPHGLDLX-UHFFFAOYSA-N
- SMILES： ClC1C(=C(C(=C(C=1C(C)=O)Cl)Cl)Cl)Cl
Computed Properties
- Exact Mass: 291.86
- Monoisotopic Mass: 289.863
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 1
- Complexity: 218
- 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
- Topological Polar Surface Area: 17.1A^2
- XLogP3: 4.7
Experimental Properties
- Density: 1.6180 (estimate)
- Melting Point: 90°C
- Boiling Point: 342.8°Cat760mmHg
- Flash Point: 144.7°C
- LogP: 5.15620
Ethanone,1-(2,3,4,5,6-pentachlorophenyl)- Related Literature
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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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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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