Cas no 62037-91-6 (benzene, 1,3-difluoro-2-(fluoromethyl)- (9ci))
62037-91-6 structure
Product Name:benzene, 1,3-difluoro-2-(fluoromethyl)- (9ci)
CAS No:62037-91-6
MF:C7H5F3
MW:146.109812498093
CID:956049
PubChem ID:45090388
Update Time:2025-04-19
benzene, 1,3-difluoro-2-(fluoromethyl)- (9ci) Chemical and Physical Properties
Names and Identifiers
-
- benzene, 1,3-difluoro-2-(fluoromethyl)- (9ci)
- 1,3-difluoro-2-(fluoromethyl)benzene
- 62037-91-6
- SCHEMBL13615074
- AKOS037655541
- DTXSID50666610
- PS-11772
-
- Inchi: 1S/C7H5F3/c8-4-5-6(9)2-1-3-7(5)10/h1-3H,4H2
- InChI Key: OGSLHFGKUCWWIK-UHFFFAOYSA-N
- SMILES: FC1C=CC=C(C=1CF)F
Computed Properties
- Exact Mass: 146.03435
- Monoisotopic Mass: 146.03433465g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 1
- Complexity: 95
- 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: 2.1
- Topological Polar Surface Area: 0?2
Experimental Properties
- PSA: 0
benzene, 1,3-difluoro-2-(fluoromethyl)- (9ci) Related Literature
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Tanya Ostapenko,Peter J. Collings,Samuel N. Sprunt,J. T. Gleeson Soft Matter, 2013,9, 9487-9498
-
Jianyao Huang,Dong Gao,Zhihui Chen,Weifeng Zhang Polym. Chem., 2021,12, 2471-2480
-
Kui Wu,Zhihua Yang,Shilie Pan Dalton Trans., 2015,44, 19856-19864
-
Chandran Rajendran,Govindaswamy Satishkumar,Charlotte Lang,Eric M. Gaigneaux Catal. Sci. Technol., 2020,10, 2583-2592
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