Cas no 63807-84-1 (Benzene, 1,3-bis(2-chloroethoxy)-)
63807-84-1 structure
Product Name:Benzene, 1,3-bis(2-chloroethoxy)-
CAS No:63807-84-1
MF:C10H12Cl2O2
MW:235.107081413269
CID:425707
PubChem ID:3407863
Update Time:2025-04-19
Benzene, 1,3-bis(2-chloroethoxy)- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 1,3-bis(2-chloroethoxy)-
- 1,3-bis(2-chloroethoxy)benzene
- 1,3-BIS-(2-CHLORO-ETHOXY)-BENZENE
- 63807-84-1
- AKOS024330974
- DTXSID30392208
-
- Inchi： 1S/C10H12Cl2O2/c11-4-6-13-9-2-1-3-10(8-9)14-7-5-12/h1-3,8H,4-7H2
- InChI Key： VVQCLPAXTIKHQZ-UHFFFAOYSA-N
- SMILES： ClCCOC1C=CC=C(C=1)OCCCl
Computed Properties
- Exact Mass: 234.02156
- Monoisotopic Mass: 234.021
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 6
- Complexity: 130
- 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: 2.6
- Topological Polar Surface Area: 18.5?2
Experimental Properties
- PSA: 18.46
Benzene, 1,3-bis(2-chloroethoxy)- Related Literature
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Rongyan Guo,Tao Li,Shuie Shi J. Mater. Chem. C, 2019,7, 5148-5154
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Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
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Xiuxia Yang,Lei Zhao,Zhichao Liu,Shuyu Tian,Hao Zhang,Xuhui Xu,Jianbei Qiu,Xue Yu Phys. Chem. Chem. Phys., 2020,22, 16294-16300
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Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
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Soumaya Khlifi,Gregory Mouille,Jonathan Farjon Anal. Methods, 2017,9, 2328-2333
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