Cas no 23426-24-6 (4-chloro-2-(chloromethyl)-1-isobutoxy-benzene)
23426-24-6 structure
Product Name:4-chloro-2-(chloromethyl)-1-isobutoxy-benzene
CAS No:23426-24-6
MF:C11H14Cl2O
MW:233.134261608124
CID:1414202
PubChem ID:43141966
Update Time:2025-04-20
4-chloro-2-(chloromethyl)-1-isobutoxy-benzene Chemical and Physical Properties
Names and Identifiers
-
- 4-chloro-2-(chloromethyl)-1-isobutoxy-benzene
- LogP
- 4-Chloro-2-(chloromethyl)-1-isobutoxybenzene
- DB-195439
- 23426-24-6
- VPIGBTRNMYTWPP-UHFFFAOYSA-N
- SCHEMBL4723254
- 4-chloro-2-(chloromethyl)-1-(2-methylpropoxy)benzene
- 4-Chloro-2-(chloromethyl)phenyl 2-methylpropyl ether
-
- Inchi： 1S/C11H14Cl2O/c1-8(2)7-14-11-4-3-10(13)5-9(11)6-12/h3-5,8H,6-7H2,1-2H3
- InChI Key： VPIGBTRNMYTWPP-UHFFFAOYSA-N
- SMILES： ClCC1C=C(C=CC=1OCC(C)C)Cl
Computed Properties
- Exact Mass: 232.04232
- Monoisotopic Mass: 232.0421705g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 4
- Complexity: 161
- 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: 4.2
- Topological Polar Surface Area: 9.2?2
Experimental Properties
- PSA: 9.23
4-chloro-2-(chloromethyl)-1-isobutoxy-benzene Related Literature
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James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
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Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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