trifluoro-[trifluoromethoxy(trifluoromethyl)phosphoryl]oxymethane

C3F9O3P — CID 87127913

IUPACtrifluoro-[trifluoromethoxy(trifluoromethyl)phosphoryl]oxymethane
SMILESO=P(OC(F)(F)F)(OC(F)(F)F)C(F)(F)F
InChIInChI=1S/C3F9O3P/c4-1(5,6)14-16(13,3(10,11)12)15-2(7,8)9
InChIKeyMOWCVYPZGYRHHH-UHFFFAOYSA-N
MW285.99 g/mol
LogP3.77
Rot. Bonds2

About trifluoro-[trifluoromethoxy(trifluoromethyl)phosphoryl]oxymethane

trifluoro-[trifluoromethoxy(trifluoromethyl)phosphoryl]oxymethane (PubChem CID 87127913) has the molecular formula C3F9O3P and a molecular weight of 285.99 g/mol. Its IUPAC name is trifluoro-[trifluoromethoxy(trifluoromethyl)phosphoryl]oxymethane.

Molecular Properties

Compound Nametrifluoro-[trifluoromethoxy(trifluoromethyl)phosphoryl]oxymethane
PubChem CID87127913
Molecular FormulaC3F9O3P
Molecular Weight285.99 g/mol
Exact Mass285.94
IUPAC Nametrifluoro-[trifluoromethoxy(trifluoromethyl)phosphoryl]oxymethane
SMILESO=P(OC(F)(F)F)(OC(F)(F)F)C(F)(F)F
InChIInChI=1S/C3F9O3P/c4-1(5,6)14-16(13,3(10,11)12)15-2(7,8)9
InChIKeyMOWCVYPZGYRHHH-UHFFFAOYSA-N
XLogP3.77
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.99
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trifluoro-[trifluoromethoxy(trifluoromethyl)phosphoryl]oxymethane?
The IUPAC name of trifluoro-[trifluoromethoxy(trifluoromethyl)phosphoryl]oxymethane (CID 87127913) is trifluoro-[trifluoromethoxy(trifluoromethyl)phosphoryl]oxymethane.
What is the SMILES notation for trifluoro-[trifluoromethoxy(trifluoromethyl)phosphoryl]oxymethane?
The canonical SMILES for trifluoro-[trifluoromethoxy(trifluoromethyl)phosphoryl]oxymethane is O=P(OC(F)(F)F)(OC(F)(F)F)C(F)(F)F.
What is the InChIKey of trifluoro-[trifluoromethoxy(trifluoromethyl)phosphoryl]oxymethane?
The InChIKey is MOWCVYPZGYRHHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C3F9O3P/c4-1(5,6)14-16(13,3(10,11)12)15-2(7,8)9.
What are the key properties of trifluoro-[trifluoromethoxy(trifluoromethyl)phosphoryl]oxymethane?
trifluoro-[trifluoromethoxy(trifluoromethyl)phosphoryl]oxymethane has a molecular weight of 285.99 g/mol, XLogP of 3.77, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trifluoro-[trifluoromethoxy(trifluoromethyl)phosphoryl]oxymethane is sourced from PubChem (CID 87127913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).