methoxy(1,1,2,2,2-pentafluoroethyl)phosphane

C3H4F5OP — CID 175489815

IUPACmethoxy(1,1,2,2,2-pentafluoroethyl)phosphane
SMILESCOPC(F)(F)C(F)(F)F
InChIInChI=1S/C3H4F5OP/c1-9-10-3(7,8)2(4,5)6/h10H,1H3
InChIKeyQBIADGVQXLXPAO-UHFFFAOYSA-N
MW182.03 g/mol
LogP2.38
Rot. Bonds2

About methoxy(1,1,2,2,2-pentafluoroethyl)phosphane

methoxy(1,1,2,2,2-pentafluoroethyl)phosphane (PubChem CID 175489815) has the molecular formula C3H4F5OP and a molecular weight of 182.03 g/mol. Its IUPAC name is methoxy(1,1,2,2,2-pentafluoroethyl)phosphane.

Molecular Properties

Compound Namemethoxy(1,1,2,2,2-pentafluoroethyl)phosphane
PubChem CID175489815
Molecular FormulaC3H4F5OP
Molecular Weight182.03 g/mol
Exact Mass181.99
IUPAC Namemethoxy(1,1,2,2,2-pentafluoroethyl)phosphane
SMILESCOPC(F)(F)C(F)(F)F
InChIInChI=1S/C3H4F5OP/c1-9-10-3(7,8)2(4,5)6/h10H,1H3
InChIKeyQBIADGVQXLXPAO-UHFFFAOYSA-N
XLogP2.38
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.03
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of methoxy(1,1,2,2,2-pentafluoroethyl)phosphane?
The IUPAC name of methoxy(1,1,2,2,2-pentafluoroethyl)phosphane (CID 175489815) is methoxy(1,1,2,2,2-pentafluoroethyl)phosphane.
What is the SMILES notation for methoxy(1,1,2,2,2-pentafluoroethyl)phosphane?
The canonical SMILES for methoxy(1,1,2,2,2-pentafluoroethyl)phosphane is COPC(F)(F)C(F)(F)F.
What is the InChIKey of methoxy(1,1,2,2,2-pentafluoroethyl)phosphane?
The InChIKey is QBIADGVQXLXPAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H4F5OP/c1-9-10-3(7,8)2(4,5)6/h10H,1H3.
What are the key properties of methoxy(1,1,2,2,2-pentafluoroethyl)phosphane?
methoxy(1,1,2,2,2-pentafluoroethyl)phosphane has a molecular weight of 182.03 g/mol, XLogP of 2.38, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methoxy(1,1,2,2,2-pentafluoroethyl)phosphane is sourced from PubChem (CID 175489815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).