methyl-bis(2,2,2-trifluoroethoxy)phosphane

C5H7F6O2P — CID 12736115

IUPACmethyl-bis(2,2,2-trifluoroethoxy)phosphane
SMILESCP(OCC(F)(F)F)OCC(F)(F)F
InChIInChI=1S/C5H7F6O2P/c1-14(12-2-4(6,7)8)13-3-5(9,10)11/h2-3H2,1H3
InChIKeyRYQSLVYVFJRHFP-UHFFFAOYSA-N
MW244.07 g/mol
LogP3.09
Rot. Bonds4

About methyl-bis(2,2,2-trifluoroethoxy)phosphane

methyl-bis(2,2,2-trifluoroethoxy)phosphane (PubChem CID 12736115) has the molecular formula C5H7F6O2P and a molecular weight of 244.07 g/mol. Its IUPAC name is methyl-bis(2,2,2-trifluoroethoxy)phosphane.

Molecular Properties

Compound Namemethyl-bis(2,2,2-trifluoroethoxy)phosphane
PubChem CID12736115
Molecular FormulaC5H7F6O2P
Molecular Weight244.07 g/mol
Exact Mass244.01
IUPAC Namemethyl-bis(2,2,2-trifluoroethoxy)phosphane
SMILESCP(OCC(F)(F)F)OCC(F)(F)F
InChIInChI=1S/C5H7F6O2P/c1-14(12-2-4(6,7)8)13-3-5(9,10)11/h2-3H2,1H3
InChIKeyRYQSLVYVFJRHFP-UHFFFAOYSA-N
XLogP3.09
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.07
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of methyl-bis(2,2,2-trifluoroethoxy)phosphane?
The IUPAC name of methyl-bis(2,2,2-trifluoroethoxy)phosphane (CID 12736115) is methyl-bis(2,2,2-trifluoroethoxy)phosphane.
What is the SMILES notation for methyl-bis(2,2,2-trifluoroethoxy)phosphane?
The canonical SMILES for methyl-bis(2,2,2-trifluoroethoxy)phosphane is CP(OCC(F)(F)F)OCC(F)(F)F.
What is the InChIKey of methyl-bis(2,2,2-trifluoroethoxy)phosphane?
The InChIKey is RYQSLVYVFJRHFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7F6O2P/c1-14(12-2-4(6,7)8)13-3-5(9,10)11/h2-3H2,1H3.
What are the key properties of methyl-bis(2,2,2-trifluoroethoxy)phosphane?
methyl-bis(2,2,2-trifluoroethoxy)phosphane has a molecular weight of 244.07 g/mol, XLogP of 3.09, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-bis(2,2,2-trifluoroethoxy)phosphane is sourced from PubChem (CID 12736115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).