Cas no 77517-67-0 (Octane, 2-fluoro-1-iodo-)
Octane, 2-fluoro-1-iodo- structure
Product Name:Octane, 2-fluoro-1-iodo-
CAS No:77517-67-0
MF:C8H16FI
MW:258.115518569946
CID:535928
PubChem ID:12669342
Update Time:2025-04-19
Octane, 2-fluoro-1-iodo- Chemical and Physical Properties
Names and Identifiers
-
- Octane, 2-fluoro-1-iodo-
- 2-fluoro-1-iodooctane
- DTXSID50506300
- 77517-67-0
- 2-fluoro-1-iodo-octane
- SCHEMBL22660970
-
- Inchi： 1S/C8H16FI/c1-2-3-4-5-6-8(9)7-10/h8H,2-7H2,1H3
- InChI Key： LRORGTWMRBHPAR-UHFFFAOYSA-N
- SMILES： ICC(CCCCCC)F
Computed Properties
- Exact Mass: 258.02768
- Monoisotopic Mass: 258.02808g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 10
- Rotatable Bond Count: 6
- Complexity: 66.3
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.6
- Topological Polar Surface Area: 0?2
Experimental Properties
- PSA: 0
Octane, 2-fluoro-1-iodo- Related Literature
-
J. M. Granadino-Roldán,M. Fernández-Gómez,A. Navarro,T. Pe?a Ruiz,U. A. Jayasooriya Phys. Chem. Chem. Phys., 2004,6, 1133-1143
-
Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
-
Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
-
James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
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