(1,1-difluoro-2-methylpropan-2-yl)-(2-phenylphenyl)phosphane

C16H17F2P — CID 151935380

IUPAC(1,1-difluoro-2-methylpropan-2-yl)-(2-phenylphenyl)phosphane
SMILESCC(C)(Pc1ccccc1-c1ccccc1)C(F)F
InChIInChI=1S/C16H17F2P/c1-16(2,15(17)18)19-14-11-7-6-10-13(14)12-8-4-3-5-9-12/h3-11,15,19H,1-2H3
InChIKeySZRIZSDMWGNFOC-UHFFFAOYSA-N
MW278.28 g/mol
LogP4.70
Rot. Bonds4

About (1,1-difluoro-2-methylpropan-2-yl)-(2-phenylphenyl)phosphane

(1,1-difluoro-2-methylpropan-2-yl)-(2-phenylphenyl)phosphane (PubChem CID 151935380) has the molecular formula C16H17F2P and a molecular weight of 278.28 g/mol. Its IUPAC name is (1,1-difluoro-2-methylpropan-2-yl)-(2-phenylphenyl)phosphane.

Molecular Properties

Compound Name(1,1-difluoro-2-methylpropan-2-yl)-(2-phenylphenyl)phosphane
PubChem CID151935380
Molecular FormulaC16H17F2P
Molecular Weight278.28 g/mol
Exact Mass278.10
IUPAC Name(1,1-difluoro-2-methylpropan-2-yl)-(2-phenylphenyl)phosphane
SMILESCC(C)(Pc1ccccc1-c1ccccc1)C(F)F
InChIInChI=1S/C16H17F2P/c1-16(2,15(17)18)19-14-11-7-6-10-13(14)12-8-4-3-5-9-12/h3-11,15,19H,1-2H3
InChIKeySZRIZSDMWGNFOC-UHFFFAOYSA-N
XLogP4.70
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.28
LogP ≤ 54.70
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 (1,1-difluoro-2-methylpropan-2-yl)-(2-phenylphenyl)phosphane?
The IUPAC name of (1,1-difluoro-2-methylpropan-2-yl)-(2-phenylphenyl)phosphane (CID 151935380) is (1,1-difluoro-2-methylpropan-2-yl)-(2-phenylphenyl)phosphane.
What is the SMILES notation for (1,1-difluoro-2-methylpropan-2-yl)-(2-phenylphenyl)phosphane?
The canonical SMILES for (1,1-difluoro-2-methylpropan-2-yl)-(2-phenylphenyl)phosphane is CC(C)(Pc1ccccc1-c1ccccc1)C(F)F.
What is the InChIKey of (1,1-difluoro-2-methylpropan-2-yl)-(2-phenylphenyl)phosphane?
The InChIKey is SZRIZSDMWGNFOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17F2P/c1-16(2,15(17)18)19-14-11-7-6-10-13(14)12-8-4-3-5-9-12/h3-11,15,19H,1-2H3.
What are the key properties of (1,1-difluoro-2-methylpropan-2-yl)-(2-phenylphenyl)phosphane?
(1,1-difluoro-2-methylpropan-2-yl)-(2-phenylphenyl)phosphane has a molecular weight of 278.28 g/mol, XLogP of 4.70, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1,1-difluoro-2-methylpropan-2-yl)-(2-phenylphenyl)phosphane is sourced from PubChem (CID 151935380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).