Cas no 902836-67-3 (2-(2,4-Difluorophenoxy)-5-fluorobenzaldehyde)
902836-67-3 structure
Product Name:2-(2,4-Difluorophenoxy)-5-fluorobenzaldehyde
CAS No:902836-67-3
MF:C13H7F3O2
MW:252.188694238663
CID:4719248
PubChem ID:42553309
Update Time:2024-03-01
2-(2,4-Difluorophenoxy)-5-fluorobenzaldehyde Chemical and Physical Properties
Names and Identifiers
-
- 2-(2,4-DIFLUOROPHENOXY)-5-FLUOROBENZALDEHYDE
- 2-(2,4-Difluoro-Phenoxy)-5-Fluoro-Benzaldehyde
- ST098726
- 2-(2,4-Difluorophenoxy)-5-fluorobenzaldehyde (ACI)
- 5-Fluoro-2-(2,4-difluorophenyloxy)benzaldehyde
- 2-(2,4-Difluorophenoxy)-5-fluorobenzaldehyde
-
- Inchi： 1S/C13H7F3O2/c14-9-1-3-12(8(5-9)7-17)18-13-4-2-10(15)6-11(13)16/h1-7H
- InChI Key： DDWJWMOYGHOQQQ-UHFFFAOYSA-N
- SMILES： FC1C=C(C=CC=1OC1C=CC(=CC=1C=O)F)F
Computed Properties
- Exact Mass: 252.03981395g/mol
- Monoisotopic Mass: 252.03981395g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 18
- Rotatable Bond Count: 3
- Complexity: 287
- 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
- Topological Polar Surface Area: 26.3
- XLogP3: 3.2
2-(2,4-Difluorophenoxy)-5-fluorobenzaldehyde Related Literature
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H. V. Jain,D. Verthelyi,S. L. Beaucage RSC Adv., 2017,7, 42519-42528
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J. M. Granadino-Roldán,M. Fernández-Gómez,A. Navarro,T. Pe?a Ruiz,U. A. Jayasooriya Phys. Chem. Chem. Phys., 2004,6, 1133-1143
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
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