Cas no 32551-62-5 (2-Ethyl-1,3-dimethoxy-5-methylbenzene)
32551-62-5 structure
Product Name:2-Ethyl-1,3-dimethoxy-5-methylbenzene
CAS No:32551-62-5
MF:C11H16O2
MW:180.243543624878
CID:2822110
PubChem ID:524845
Update Time:2025-04-21
2-Ethyl-1,3-dimethoxy-5-methylbenzene Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 1,3-dimethoxy-2-ethyl-5-methyl
- SCHEMBL5141794
- DTXSID10335370
- 32551-62-5
- DTXCID10286459
- 2-Ethyl-1,3-dimethoxy-5-methylbenzene
-
- Inchi： 1S/C11H16O2/c1-5-9-10(12-3)6-8(2)7-11(9)13-4/h6-7H,5H2,1-4H3
- InChI Key： KBHCITMKIJKTSU-UHFFFAOYSA-N
- SMILES： O(C)C1C=C(C)C=C(C=1CC)OC
Computed Properties
- Exact Mass: 180.115029749g/mol
- Monoisotopic Mass: 180.115029749g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 3
- Complexity: 133
- 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
- Topological Polar Surface Area: 18.5?2
2-Ethyl-1,3-dimethoxy-5-methylbenzene Related Literature
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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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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