(4-fluoro-2-pentan-2-ylphenyl)phosphane

C11H16FP — CID 174672226

IUPAC(4-fluoro-2-pentan-2-ylphenyl)phosphane
SMILESCCCC(C)c1cc(F)ccc1P
InChIInChI=1S/C11H16FP/c1-3-4-8(2)10-7-9(12)5-6-11(10)13/h5-8H,3-4,13H2,1-2H3
InChIKeyFZBDSJNFGMUQQZ-UHFFFAOYSA-N
MW198.22 g/mol
LogP3.23
Rot. Bonds3

About (4-fluoro-2-pentan-2-ylphenyl)phosphane

(4-fluoro-2-pentan-2-ylphenyl)phosphane (PubChem CID 174672226) has the molecular formula C11H16FP and a molecular weight of 198.22 g/mol. Its IUPAC name is (4-fluoro-2-pentan-2-ylphenyl)phosphane.

Molecular Properties

Compound Name(4-fluoro-2-pentan-2-ylphenyl)phosphane
PubChem CID174672226
Molecular FormulaC11H16FP
Molecular Weight198.22 g/mol
Exact Mass198.10
IUPAC Name(4-fluoro-2-pentan-2-ylphenyl)phosphane
SMILESCCCC(C)c1cc(F)ccc1P
InChIInChI=1S/C11H16FP/c1-3-4-8(2)10-7-9(12)5-6-11(10)13/h5-8H,3-4,13H2,1-2H3
InChIKeyFZBDSJNFGMUQQZ-UHFFFAOYSA-N
XLogP3.23
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.22
LogP ≤ 53.23
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

3-(5-fluoro-2-methylphenyl)-N-propylbutan-1-amine
CID 81019160
(1R)-1-[5-fluoro-2-(trifluoromethyl)phenyl]butan-1-amine
CID 79021281
N-[1-(2,5-difluorophenyl)ethyl]pentan-2-amine
CID 43191491
1-[5-fluoro-2-(trifluoromethyl)phenyl]butan-1-amine
CID 79016521
[4-fluoro-2-(2-methylpentan-2-yl)phenyl]phosphane
CID 174683734
1-(2-ethyl-5-fluorophenyl)butan-1-amine
CID 55268868
2-[(1S)-1-aminobutyl]-4-fluoroaniline
CID 130859699
4-fluoro-2-pentan-2-ylpyridine
CID 134243640
(1S)-1-[5-fluoro-2-(trifluoromethyl)phenyl]butan-1-amine;hydrochloride
CID 171228674
(1S)-1-(2-bromo-5-fluorophenyl)butan-1-amine
CID 103694433
1-(2-bromo-5-fluorophenyl)butan-1-amine
CID 83988354
4-fluoro-2-[1-[methyl(pentan-2-yl)amino]ethyl]phenol
CID 82977766

Frequently Asked Questions

What is the IUPAC name of (4-fluoro-2-pentan-2-ylphenyl)phosphane?
The IUPAC name of (4-fluoro-2-pentan-2-ylphenyl)phosphane (CID 174672226) is (4-fluoro-2-pentan-2-ylphenyl)phosphane.
What is the SMILES notation for (4-fluoro-2-pentan-2-ylphenyl)phosphane?
The canonical SMILES for (4-fluoro-2-pentan-2-ylphenyl)phosphane is CCCC(C)c1cc(F)ccc1P.
What is the InChIKey of (4-fluoro-2-pentan-2-ylphenyl)phosphane?
The InChIKey is FZBDSJNFGMUQQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16FP/c1-3-4-8(2)10-7-9(12)5-6-11(10)13/h5-8H,3-4,13H2,1-2H3.
What are the key properties of (4-fluoro-2-pentan-2-ylphenyl)phosphane?
(4-fluoro-2-pentan-2-ylphenyl)phosphane has a molecular weight of 198.22 g/mol, XLogP of 3.23, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluoro-2-pentan-2-ylphenyl)phosphane is sourced from PubChem (CID 174672226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).