2-Methyl-1-pentyl methylphosphonofluoridate
Basic information
- CAS
333416-05-0- Standard SMILES
CCCC(C)COP(C)(=O)F- InChIKey
XHEQIFJOVPJLNW-UHFFFAOYSA-N- Molecular formula
- C7H16FO2P
- Average molar mass
- 182.17 g/mol
- Monoisotopic mass
- 182.08719491
Names & identifiers
- Preferred name
- 2-Methyl-1-pentyl methylphosphonofluoridate
- IUPAC
- 1-[fluoro(methyl)phosphoryl]oxy-2-methylpentane
Names & synonyms
2-Methyl-1-pentyl methylphosphonofluoridateDTXSID1013671612-Methylpentyl P-methylphosphonofluoridateO-2-Methylpentyl methylphosphonofluoridate2-Methylpentyl methylphosphonofluoridoate #Phosphonofluoridic acid, methyl-, 2-methylpentyl esterMethylphoshonic acid, fluoroanhydride, 2-methylpenthyl ester333416-05-0
Database identifiers
- CAS
333416-05-0- PubChem CID
- 567433
- DTXSID
DTXSID101367161
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 149
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Compound notes
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