4-(4-propan-2-ylphenyl)phosphinine

C14H15P — CID 142128877

IUPAC4-(4-propan-2-ylphenyl)phosphinine
SMILESCC(C)c1ccc(-c2ccpcc2)cc1
InChIInChI=1S/C14H15P/c1-11(2)12-3-5-13(6-4-12)14-7-9-15-10-8-14/h3-11H,1-2H3
InChIKeyHEDJEFXLLVMOLB-UHFFFAOYSA-N
MW214.25 g/mol
LogP5.06
Rot. Bonds2

About 4-(4-propan-2-ylphenyl)phosphinine

4-(4-propan-2-ylphenyl)phosphinine (PubChem CID 142128877) has the molecular formula C14H15P and a molecular weight of 214.25 g/mol. Its IUPAC name is 4-(4-propan-2-ylphenyl)phosphinine.

Molecular Properties

Compound Name4-(4-propan-2-ylphenyl)phosphinine
PubChem CID142128877
Molecular FormulaC14H15P
Molecular Weight214.25 g/mol
Exact Mass214.09
IUPAC Name4-(4-propan-2-ylphenyl)phosphinine
SMILESCC(C)c1ccc(-c2ccpcc2)cc1
InChIInChI=1S/C14H15P/c1-11(2)12-3-5-13(6-4-12)14-7-9-15-10-8-14/h3-11H,1-2H3
InChIKeyHEDJEFXLLVMOLB-UHFFFAOYSA-N
XLogP5.06
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500214.25
LogP ≤ 55.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 4-(4-propan-2-ylphenyl)phosphinine?
The IUPAC name of 4-(4-propan-2-ylphenyl)phosphinine (CID 142128877) is 4-(4-propan-2-ylphenyl)phosphinine.
What is the SMILES notation for 4-(4-propan-2-ylphenyl)phosphinine?
The canonical SMILES for 4-(4-propan-2-ylphenyl)phosphinine is CC(C)c1ccc(-c2ccpcc2)cc1.
What is the InChIKey of 4-(4-propan-2-ylphenyl)phosphinine?
The InChIKey is HEDJEFXLLVMOLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15P/c1-11(2)12-3-5-13(6-4-12)14-7-9-15-10-8-14/h3-11H,1-2H3.
What are the key properties of 4-(4-propan-2-ylphenyl)phosphinine?
4-(4-propan-2-ylphenyl)phosphinine has a molecular weight of 214.25 g/mol, XLogP of 5.06, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-propan-2-ylphenyl)phosphinine is sourced from PubChem (CID 142128877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).