Cas no 17847-54-0 (3,4-Dichlorophenetole)
3,4-Dichlorophenetole structure
Product Name:3,4-Dichlorophenetole
CAS No:17847-54-0
MF:C8H8Cl2O
MW:191.054520606995
CID:890724
PubChem ID:20445461
Update Time:2024-02-27
3,4-Dichlorophenetole Chemical and Physical Properties
Names and Identifiers
-
- 3,4-DICHLOROPHENETOLE
- 1,2-dichloro-4-ethoxybenzene
- PubChem3242
- 3,4-Dichlorophenylethyl ether
- AS02888
- 3,4-Dichlorophenetole
-
- Inchi： 1S/C8H8Cl2O/c1-2-11-6-3-4-7(9)8(10)5-6/h3-5H,2H2,1H3
- InChI Key： XNQPWFQUTKAKMD-UHFFFAOYSA-N
- SMILES： ClC1=C(C=CC(=C1)OCC)Cl
Computed Properties
- Exact Mass: 189.9952203g/mol
- Monoisotopic Mass: 189.9952203g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 119
- 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: 3.6
- Topological Polar Surface Area: 9.2
3,4-Dichlorophenetole Related Literature
-
Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
-
M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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