Cas no 63818-95-1 ((2S)-2-Fluoro-2-phenylacetic acid)
63818-95-1 structure
Product Name:(2S)-2-Fluoro-2-phenylacetic acid
CAS No:63818-95-1
MF:C8H7FO2
MW:154.138386011124
CID:425669
PubChem ID:7003723
Update Time:2024-03-01
(2S)-2-Fluoro-2-phenylacetic acid Chemical and Physical Properties
Names and Identifiers
-
- Benzeneacetic acid, a-fluoro-, (S)-
- (S)-alpha-Fluorobenzeneacetic acid
- (S)-2-Fluoro-2-phenylacetic acid
- (2S)-2-Fluoro-2-phenylacetic acid
-
- Inchi： 1S/C8H7FO2/c9-7(8(10)11)6-4-2-1-3-5-6/h1-5,7H,(H,10,11)/t7-/m0/s1
- InChI Key： ATPPNMLQNZHDOG-ZETCQYMHSA-N
- SMILES： F[C@H](C(=O)O)C1C=CC=CC=1
Computed Properties
- Exact Mass: 154.04300762g/mol
- Monoisotopic Mass: 154.04300762g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 141
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 37.3
- XLogP3: 1.9
(2S)-2-Fluoro-2-phenylacetic acid Related Literature
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Yingbo Li,Nada Mehio,Huizhou Liu,Sheng Dai Green Chem., 2015,17, 2981-2993
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Felix Witte,Philipp Rietsch,Nithiya Nirmalananthan-Budau,Florian Weigert,Jan P. G?tze,Ute Resch-Genger,Siegfried Eigler,Beate Paulus Phys. Chem. Chem. Phys., 2021,23, 17521-17529
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Eunice Y.-L. Hui,Bhimsen Rout,Yaw Sing Tan,Kok-Ping Chan,Charles W. Johannes Org. Biomol. Chem., 2018,16, 389-392
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Ke Chen,Shuai Liu,Liang Mei,Feng Jin,Bo Zhang,Fengxiang Ma,Yewei Chen,Hong Deng,Min Guo,Qingxu Yu Analyst, 2020,145, 1524-1530
-
H. V. Jain,D. Verthelyi,S. L. Beaucage RSC Adv., 2017,7, 42519-42528
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