diethyl(3,3,3-trifluoropropyl)phosphane

C7H14F3P — CID 90297880

IUPACdiethyl(3,3,3-trifluoropropyl)phosphane
SMILESCCP(CC)CCC(F)(F)F
InChIInChI=1S/C7H14F3P/c1-3-11(4-2)6-5-7(8,9)10/h3-6H2,1-2H3
InChIKeyITPCTIICGRXDGF-UHFFFAOYSA-N
MW186.16 g/mol
LogP3.46
Rot. Bonds4

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

diethyl(3,3,3-trifluoropropyl)phosphane (PubChem CID 90297880) has the molecular formula C7H14F3P and a molecular weight of 186.16 g/mol. Its IUPAC name is diethyl(3,3,3-trifluoropropyl)phosphane.

Molecular Properties

Compound Namediethyl(3,3,3-trifluoropropyl)phosphane
PubChem CID90297880
Molecular FormulaC7H14F3P
Molecular Weight186.16 g/mol
Exact Mass186.08
IUPAC Namediethyl(3,3,3-trifluoropropyl)phosphane
SMILESCCP(CC)CCC(F)(F)F
InChIInChI=1S/C7H14F3P/c1-3-11(4-2)6-5-7(8,9)10/h3-6H2,1-2H3
InChIKeyITPCTIICGRXDGF-UHFFFAOYSA-N
XLogP3.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.16
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

Di(propan-2-yl)-sulfanylidene-(1,2,2-trifluoroethenyl)-lambda5-phosphane
CID 85992677
Butylbis(trifluoromethyl)phosphine sulfide
CID 544621
Dimethyl(3,3,3-trifluoropropyl)phosphane
CID 12844542
Difluoromethyl(diethyl)phosphane
CID 13760734
1-[Bis(trifluoromethyl)phosphanyl]butan-2-yl-bis(trifluoromethyl)phosphane
CID 20063726
Trimethyl(2,2,2-trifluoroethyl)phosphanium
CID 20802391
Tributyl(2,2,2-trifluoroethyl)phosphanium
CID 21062497
Tributyl(trifluoromethyl)phosphanium
CID 21062500
Triethyl(1,1,2,2,3,3,3-heptafluoropropyl)phosphanium
CID 21062501
Triethyl(trifluoromethyl)phosphanium
CID 21062502
Butyl(trifluoromethyl)phosphane
CID 21096689
Hexyl(trifluoromethyl)phosphane
CID 21096780

Frequently Asked Questions

What is the IUPAC name of diethyl(3,3,3-trifluoropropyl)phosphane?
The IUPAC name of diethyl(3,3,3-trifluoropropyl)phosphane (CID 90297880) is diethyl(3,3,3-trifluoropropyl)phosphane.
What is the SMILES notation for diethyl(3,3,3-trifluoropropyl)phosphane?
The canonical SMILES for diethyl(3,3,3-trifluoropropyl)phosphane is CCP(CC)CCC(F)(F)F.
What is the InChIKey of diethyl(3,3,3-trifluoropropyl)phosphane?
The InChIKey is ITPCTIICGRXDGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14F3P/c1-3-11(4-2)6-5-7(8,9)10/h3-6H2,1-2H3.
What are the key properties of diethyl(3,3,3-trifluoropropyl)phosphane?
diethyl(3,3,3-trifluoropropyl)phosphane has a molecular weight of 186.16 g/mol, XLogP of 3.46, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for diethyl(3,3,3-trifluoropropyl)phosphane is sourced from PubChem (CID 90297880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).