Cas no 62679-58-7 (2,4-Hexanedione, 1,1-difluoro-)
62679-58-7 structure
Product Name:2,4-Hexanedione, 1,1-difluoro-
CAS No:62679-58-7
MF:C6H8F2O2
MW:150.123329162598
CID:435485
PubChem ID:23005495
Update Time:2025-04-19
2,4-Hexanedione, 1,1-difluoro- Chemical and Physical Properties
Names and Identifiers
-
- 2,4-Hexanedione, 1,1-difluoro-
- 1,1-difluorohexane-2,4-dione
- AKOS004115358
- 62679-58-7
- DHIMMJNBKAADDP-UHFFFAOYSA-N
- DTXSID50629669
- SCHEMBL11518372
-
- Inchi： 1S/C6H8F2O2/c1-2-4(9)3-5(10)6(7)8/h6H,2-3H2,1H3
- InChI Key： DHIMMJNBKAADDP-UHFFFAOYSA-N
- SMILES： FC(C(CC(CC)=O)=O)F
Computed Properties
- Exact Mass: 150.04924
- Monoisotopic Mass: 150.04923582g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 10
- Rotatable Bond Count: 4
- Complexity: 143
- 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: 1.1
- Topological Polar Surface Area: 34.1?2
Experimental Properties
- PSA: 34.14
2,4-Hexanedione, 1,1-difluoro- Related Literature
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
-
Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
-
Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
-
J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
-
M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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