Cas no 80277-49-2 (Benzoyl fluoride, 2,5-dichloro- (9CI))
80277-49-2 structure
Product Name:Benzoyl fluoride, 2,5-dichloro- (9CI)
CAS No:80277-49-2
MF:C7H3Cl2FO
MW:193.00252366066
CID:985356
PubChem ID:19849169
Update Time:2025-04-20
Benzoyl fluoride, 2,5-dichloro- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Benzoyl fluoride, 2,5-dichloro- (9CI)
- 2,5-dichlorobenzoyl fluoride
- 80277-49-2
- benzoyl fluoride, 2,5-dichloro-
- DTXSID40600588
- SCHEMBL10541315
- DB-275031
-
- Inchi： 1S/C7H3Cl2FO/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3H
- InChI Key： PJUBAOJCWASILS-UHFFFAOYSA-N
- SMILES： ClC1C=CC(=CC=1C(=O)F)Cl
Computed Properties
- Exact Mass: 191.9544983g/mol
- Monoisotopic Mass: 191.9544983g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 163
- 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: 3.3
- Topological Polar Surface Area: 17.1?2
Benzoyl fluoride, 2,5-dichloro- (9CI) Related Literature
-
Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
-
Daniel Messmer,Stefan Salentinig,Jakob Heier Nanoscale, 2019,11, 6929-6938
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
-
Jonas Kind,Lukas Kaltschnee,Martin Leyendecker,Christina M. Thiele Chem. Commun., 2016,52, 12506-12509
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