Cas no 220870-73-5 (Benzene,1-(dichloromethyl)-4-ethoxy-)
220870-73-5 structure
Product Name:Benzene,1-(dichloromethyl)-4-ethoxy-
CAS No:220870-73-5
MF:C9H10Cl2O
MW:205.081100940704
CID:244060
PubChem ID:45094027
Update Time:2025-04-19
Benzene,1-(dichloromethyl)-4-ethoxy- Chemical and Physical Properties
Names and Identifiers
-
- Benzene,1-(dichloromethyl)-4-ethoxy-
- 1-Dichloromethyl-4-ethoxybenzene
- 1-(dichloromethyl)-4-ethoxybenzene
- MFCD18825106
- DTXSID20667235
- 220870-73-5
- SY330957
-
- Inchi： 1S/C9H10Cl2O/c1-2-12-8-5-3-7(4-6-8)9(10)11/h3-6,9H,2H2,1H3
- InChI Key： XHJWDSXWBCXVCR-UHFFFAOYSA-N
- SMILES： ClC(C1C=CC(=CC=1)OCC)Cl
Computed Properties
- Exact Mass: 204.011
- Monoisotopic Mass: 204.011
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 120
- 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: 9.2A^2
- XLogP3: 3.4
Experimental Properties
- PSA: 9.23
Benzene,1-(dichloromethyl)-4-ethoxy- Related Literature
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
-
Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
-
Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
-
Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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