Cas no 864684-83-3 (Benzoic acid,4-(fluoromethoxy)-3,5-dimethoxy-, methyl ester)
864684-83-3 structure
Product Name:Benzoic acid,4-(fluoromethoxy)-3,5-dimethoxy-, methyl ester
CAS No:864684-83-3
MF:C11H13FO5
MW:244.216327428818
CID:718610
PubChem ID:17999203
Update Time:2025-04-19
Benzoic acid,4-(fluoromethoxy)-3,5-dimethoxy-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid,4-(fluoromethoxy)-3,5-dimethoxy-, methyl ester
- 4-FLUOROMETHOXY-3,5-DIMETHOXY-BENZOIC ACID METHYL ESTER
- DTXSID20592270
- methyl 4-(fluoromethoxy)-3,5-dimethoxybenzoate
- 864684-83-3
- 4-Fluoromethoxy-3,5-dimethoxybenzoic acid methyl ester
-
- Inchi： 1S/C11H13FO5/c1-14-8-4-7(11(13)16-3)5-9(15-2)10(8)17-6-12/h4-5H,6H2,1-3H3
- InChI Key： TVSFNIXJPOCZKG-UHFFFAOYSA-N
- SMILES： FCOC1C(=CC(C(=O)OC)=CC=1OC)OC
Computed Properties
- Exact Mass: 244.07470167g/mol
- Monoisotopic Mass: 244.07470167g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 17
- Rotatable Bond Count: 6
- Complexity: 234
- 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: 2.1
- Topological Polar Surface Area: 54?2
Benzoic acid,4-(fluoromethoxy)-3,5-dimethoxy-, methyl ester Related Literature
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Jing Chen,Yu Shao,Danzhen Li J. Mater. Chem. A, 2017,5, 937-941
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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