Cas no 781673-70-9 (Benzene,1-(4-fluorophenoxy)-3,5-dimethyl-)
781673-70-9 structure
Product Name:Benzene,1-(4-fluorophenoxy)-3,5-dimethyl-
CAS No:781673-70-9
MF:C14H13FO
MW:216.250827550888
CID:553938
PubChem ID:11736061
Update Time:2025-04-19
Benzene,1-(4-fluorophenoxy)-3,5-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzene,1-(4-fluorophenoxy)-3,5-dimethyl-
- Benzene, 1-(4-fluorophenoxy)-3,5-dimethyl- (9CI)
- 1-(4-fluorophenoxy)-3,5-dimethylbenzene
- DTXSID60471358
- AG-H-13589
- 781673-70-9
- SCHEMBL18415593
- 4-Fluoro-3',5'-dimethyldiphenyl ether
-
- Inchi： 1S/C14H13FO/c1-10-7-11(2)9-14(8-10)16-13-5-3-12(15)4-6-13/h3-9H,1-2H3
- InChI Key： QTEPPVKSLLTWPG-UHFFFAOYSA-N
- SMILES： FC1C=CC(=CC=1)OC1C=C(C)C=C(C)C=1
Computed Properties
- Exact Mass: 216.095043196g/mol
- Monoisotopic Mass: 216.095043196g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 201
- 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: 4.3
- Topological Polar Surface Area: 9.2?2
Benzene,1-(4-fluorophenoxy)-3,5-dimethyl- Related Literature
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Zhizhen Lai,Mo Zhang,Jinyu Zhou,Tianjing Chen,Dan Li,Xuejing Shen,Jia Liu,Jiang Zhou,Zhili Li Analyst, 2021,146, 4261-4267
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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