methyl(3,3,3-trifluoropropyl)phosphane

C4H8F3P — CID 87438485

IUPACmethyl(3,3,3-trifluoropropyl)phosphane
SMILESCPCCC(F)(F)F
InChIInChI=1S/C4H8F3P/c1-8-3-2-4(5,6)7/h8H,2-3H2,1H3
InChIKeyPNGLMZDCEBJERL-UHFFFAOYSA-N
MW144.08 g/mol
LogP2.25
Rot. Bonds2

About methyl(3,3,3-trifluoropropyl)phosphane

methyl(3,3,3-trifluoropropyl)phosphane (PubChem CID 87438485) has the molecular formula C4H8F3P and a molecular weight of 144.08 g/mol. Its IUPAC name is methyl(3,3,3-trifluoropropyl)phosphane.

Molecular Properties

Compound Namemethyl(3,3,3-trifluoropropyl)phosphane
PubChem CID87438485
Molecular FormulaC4H8F3P
Molecular Weight144.08 g/mol
Exact Mass144.03
IUPAC Namemethyl(3,3,3-trifluoropropyl)phosphane
SMILESCPCCC(F)(F)F
InChIInChI=1S/C4H8F3P/c1-8-3-2-4(5,6)7/h8H,2-3H2,1H3
InChIKeyPNGLMZDCEBJERL-UHFFFAOYSA-N
XLogP2.25
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.08
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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(3,3,3-trifluoropropyl)phosphane?
The IUPAC name of methyl(3,3,3-trifluoropropyl)phosphane (CID 87438485) is methyl(3,3,3-trifluoropropyl)phosphane.
What is the SMILES notation for methyl(3,3,3-trifluoropropyl)phosphane?
The canonical SMILES for methyl(3,3,3-trifluoropropyl)phosphane is CPCCC(F)(F)F.
What is the InChIKey of methyl(3,3,3-trifluoropropyl)phosphane?
The InChIKey is PNGLMZDCEBJERL-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8F3P/c1-8-3-2-4(5,6)7/h8H,2-3H2,1H3.
What are the key properties of methyl(3,3,3-trifluoropropyl)phosphane?
methyl(3,3,3-trifluoropropyl)phosphane has a molecular weight of 144.08 g/mol, XLogP of 2.25, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methyl(3,3,3-trifluoropropyl)phosphane is sourced from PubChem (CID 87438485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).