1,2,2-trifluoro-3,3-diphenylphospholane

C16H14F3P — CID 87289270

IUPAC1,2,2-trifluoro-3,3-diphenylphospholane
SMILESFP1CCC(c2ccccc2)(c2ccccc2)C1(F)F
InChIInChI=1S/C16H14F3P/c17-16(18)15(11-12-20(16)19,13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10H,11-12H2
InChIKeyGKTLORVGTFDXKT-UHFFFAOYSA-N
MW294.26 g/mol
LogP5.34
Rot. Bonds2

About 1,2,2-trifluoro-3,3-diphenylphospholane

1,2,2-trifluoro-3,3-diphenylphospholane (PubChem CID 87289270) has the molecular formula C16H14F3P and a molecular weight of 294.26 g/mol. Its IUPAC name is 1,2,2-trifluoro-3,3-diphenylphospholane.

Molecular Properties

Compound Name1,2,2-trifluoro-3,3-diphenylphospholane
PubChem CID87289270
Molecular FormulaC16H14F3P
Molecular Weight294.26 g/mol
Exact Mass294.08
IUPAC Name1,2,2-trifluoro-3,3-diphenylphospholane
SMILESFP1CCC(c2ccccc2)(c2ccccc2)C1(F)F
InChIInChI=1S/C16H14F3P/c17-16(18)15(11-12-20(16)19,13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10H,11-12H2
InChIKeyGKTLORVGTFDXKT-UHFFFAOYSA-N
XLogP5.34
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500294.26
LogP ≤ 55.34
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 1,2,2-trifluoro-3,3-diphenylphospholane?
The IUPAC name of 1,2,2-trifluoro-3,3-diphenylphospholane (CID 87289270) is 1,2,2-trifluoro-3,3-diphenylphospholane.
What is the SMILES notation for 1,2,2-trifluoro-3,3-diphenylphospholane?
The canonical SMILES for 1,2,2-trifluoro-3,3-diphenylphospholane is FP1CCC(c2ccccc2)(c2ccccc2)C1(F)F.
What is the InChIKey of 1,2,2-trifluoro-3,3-diphenylphospholane?
The InChIKey is GKTLORVGTFDXKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14F3P/c17-16(18)15(11-12-20(16)19,13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10H,11-12H2.
What are the key properties of 1,2,2-trifluoro-3,3-diphenylphospholane?
1,2,2-trifluoro-3,3-diphenylphospholane has a molecular weight of 294.26 g/mol, XLogP of 5.34, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,2-trifluoro-3,3-diphenylphospholane is sourced from PubChem (CID 87289270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).