Cas no 161941-22-6 (Bicyclo[3.2.0]heptan-2-one, 7,7-difluoro- (9CI))
161941-22-6 structure
Product Name:Bicyclo[3.2.0]heptan-2-one, 7,7-difluoro- (9CI)
CAS No:161941-22-6
MF:C7H8F2O
MW:146.134629249573
CID:904623
PubChem ID:14939334
Update Time:2025-04-19
Bicyclo[3.2.0]heptan-2-one, 7,7-difluoro- (9CI) Chemical and Physical Properties
Names and Identifiers
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- Bicyclo[3.2.0]heptan-2-one, 7,7-difluoro- (9CI)
- 161941-22-6
- Bicyclo[3.2.0]heptan-2-one, 7,7-difluoro-
- 7,7-Difluorobicyclo[3.2.0]heptan-2-one
-
- Inchi: 1S/C7H8F2O/c8-7(9)3-4-1-2-5(10)6(4)7/h4,6H,1-3H2
- InChI Key: FJTZIGNYUXTTJL-UHFFFAOYSA-N
- SMILES: FC1(CC2CCC(C21)=O)F
Computed Properties
- Exact Mass: 146.05434
- Monoisotopic Mass: 146.05432120g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 0
- Complexity: 188
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.1
- Topological Polar Surface Area: 17.1?2
Experimental Properties
- PSA: 17.07
Bicyclo[3.2.0]heptan-2-one, 7,7-difluoro- (9CI) Related Literature
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Prajwalita Das,Kiyoteru Niina,Tomoya Hiromura,Etsuko Tokunaga,Norimichi Saito Chem. Sci., 2018,9, 4931-4936
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Yi-Bin Ruan,Alexis Depauw,Isabelle Leray Org. Biomol. Chem., 2014,12, 4335-4341
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Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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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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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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