Cas no 68537-14-4 (Benzene, 4-chloro-1-(ethenyloxy)-2-methyl-)
68537-14-4 structure
Product Name:Benzene, 4-chloro-1-(ethenyloxy)-2-methyl-
CAS No:68537-14-4
MF:C9H9ClO
MW:168.620161771774
CID:392940
PubChem ID:13141432
Update Time:2025-04-19
Benzene, 4-chloro-1-(ethenyloxy)-2-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 4-chloro-1-(ethenyloxy)-2-methyl-
- 4-chloro-1-ethenoxy-2-methylbenzene
- 68537-14-4
- DTXSID40521289
- AKOS015711114
- 4-Chloro-1-(ethenyloxy)-2-methylbenzene
-
- Inchi： 1S/C9H9ClO/c1-3-11-9-5-4-8(10)6-7(9)2/h3-6H,1H2,2H3
- InChI Key： HCAHHUGEFMNRFY-UHFFFAOYSA-N
- SMILES： ClC1C=CC(=C(C)C=1)OC=C
Computed Properties
- Exact Mass: 168.03427
- Monoisotopic Mass: 168.0341926g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 136
- 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: 3.4
- Topological Polar Surface Area: 9.2?2
Experimental Properties
- PSA: 9.23
Benzene, 4-chloro-1-(ethenyloxy)-2-methyl- Related Literature
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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Andre Prates Pereira,Tao Dong,Eric P. Knoshaug,Nick Nagle,Ryan Spiller,Bonnie Panczak,Christopher J. Chuck,Philip T. Pienkos Sustainable Energy Fuels, 2020,4, 3400-3408
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