Cas no 16048-45-6 (Benzeneacetic acid,3-fluoro-, 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester)
![Benzeneacetic acid,3-fluoro-, 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester structure](https://ossimg.kuujia.com/scimg/16500/16048-45-6x500.png)
16048-45-6 structure
Product Name:Benzeneacetic acid,3-fluoro-, 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester
CAS No:16048-45-6
MF:C16H20FNO2
MW:277.333908081055
CID:170379
PubChem ID:85950
Update Time:2025-04-19
Benzeneacetic acid,3-fluoro-, 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester Chemical and Physical Properties
Names and Identifiers
-
- Benzeneacetic acid,3-fluoro-, 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester
- Acetic acid, (m-fluorophenyl)-, tropan-3-yl ester hydrochloride
- 8-Methyl-8-azabicyclo[3.2.1]octan-3-yl (3-fluorophenyl)acetate
- DTXSID20936317
- 16048-45-6
- Benzeneacetic acid, 3-fluoro-, 8-methyl-8-azabicyclo(3.2.1)oct-3-yl ester
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- Inchi： 1S/C16H20FNO2/c1-18-13-5-6-14(18)10-15(9-13)20-16(19)8-11-3-2-4-12(17)7-11/h2-4,7,13-15H,5-6,8-10H2,1H3
- InChI Key： SKFBCNNCGWHFDQ-UHFFFAOYSA-N
- SMILES： FC1=CC=CC(=C1)CC(=O)OC1CC2CCC(C1)N2C
Computed Properties
- Exact Mass: 277.1479
- Monoisotopic Mass: 277.148
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 20
- Rotatable Bond Count: 4
- Complexity: 348
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3
- Topological Polar Surface Area: 29.5?2
Experimental Properties
- Density: 1.19
- Boiling Point: 355.4°Cat760mmHg
- Flash Point: 168.8°C
- Refractive Index: 1.555
- PSA: 29.54
Benzeneacetic acid,3-fluoro-, 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester Related Literature
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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3. An integrated microfluidic 3D tumor system for parallel and high-throughput chemotherapy evaluation?Dan Liu,Rui Hu,Zhongchao Huang,Meilin Sun,Kai Han Analyst, 2020,145, 6447-6455
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Xin Li,Liangliang Zhu,Sai Duan,Yanli Zhao,Hans ?gren Phys. Chem. Chem. Phys., 2014,16, 23854-23860
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