Cas no 763109-04-2 ( )
structure
Product Name:
CAS No:763109-04-2
MF:C11H8FNO4
MW:237.183926582336
CID:870683
PubChem ID:45054408
Update Time:2025-04-19
Chemical and Physical Properties
Names and Identifiers
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- (4-FLUORO-2-(5-ISOXAZOLYL)PHENOXY)ACETIC ACID
- 2-(4-FLUORO-2-(ISOXAZOL-5-YL)PHENOXY)ACETIC ACID
- 2-[4-fluoro-2-(1,2-oxazol-5-yl)phenoxy]acetic acid
- [4-Fluoro-2-(1,2-oxazol-5-yl)phenoxy]acetic acid
- AKOS024417683
- DTXSID40662343
- 763109-04-2
-
-
- Inchi： 1S/C11H8FNO4/c12-7-1-2-9(16-6-11(14)15)8(5-7)10-3-4-13-17-10/h1-5H,6H2,(H,14,15)
- InChI Key： PJHKJGBSUVCXJB-UHFFFAOYSA-N
- SMILES： FC1C=CC(=C(C=1)C1=CC=NO1)OCC(=O)O
Computed Properties
- Exact Mass: 237.04373590g/mol
- Monoisotopic Mass: 237.04373590g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 17
- Rotatable Bond Count: 4
- Complexity: 276
- 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: 1.7
- Topological Polar Surface Area: 72.6?2
Related Literature
-
Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
-
Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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