Phosphonofluoridic acid, methyl-, 4-methylcyclohexyl ester
Basic information
- CAS
113548-87-1- Standard SMILES
CC1CCC(OP(C)(=O)F)CC1- InChIKey
XXMCSQLEFVICLL-UHFFFAOYSA-N- Molecular formula
- C8H16FO2P
- Average molar mass
- 194.18 g/mol
- Monoisotopic mass
- 194.08719491
Names & identifiers
- Preferred name
- Phosphonofluoridic acid, methyl-, 4-methylcyclohexyl ester
- IUPAC
- 1-[fluoro(methyl)phosphoryl]oxy-4-methylcyclohexane
Names & synonyms
113548-87-1Phosphonofluoridic acid, methyl-, 4-methylcyclohexyl esterDTXSID90340780RefChem:370701DTXCID102918614-Methylcyclohexyl methylphosphonofluoridateXXMCSQLEFVICLL-IWTGGTBMSA-NXXMCSQLEFVICLL-UHFFFAOYSA-N4-Methylcyclohexyl methylphosphonofluoridoate #Phosphonofluoridic acid, methyl-, trans-4-methylcyclohexyl ester
Database identifiers
- CAS
113548-87-1- PubChem CID
- 567320
- DTXSID
DTXSID90340780- Nikkaji
- J2.804.782G
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 187
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Related reactions
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Compound notes
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