4-(4-fluorophenyl)-2-propylphenol

C15H15FO — CID 22458869

IUPAC4-(4-fluorophenyl)-2-propylphenol
SMILESCCCc1cc(-c2ccc(F)cc2)ccc1O
InChIInChI=1S/C15H15FO/c1-2-3-13-10-12(6-9-15(13)17)11-4-7-14(16)8-5-11/h4-10,17H,2-3H2,1H3
InChIKeyVLVAINRVXJSXMV-UHFFFAOYSA-N
MW230.28 g/mol
LogP4.15
Rot. Bonds3

About 4-(4-fluorophenyl)-2-propylphenol

4-(4-fluorophenyl)-2-propylphenol (PubChem CID 22458869) has the molecular formula C15H15FO and a molecular weight of 230.28 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-2-propylphenol.

Molecular Properties

Compound Name4-(4-fluorophenyl)-2-propylphenol
PubChem CID22458869
Molecular FormulaC15H15FO
Molecular Weight230.28 g/mol
Exact Mass230.11
IUPAC Name4-(4-fluorophenyl)-2-propylphenol
SMILESCCCc1cc(-c2ccc(F)cc2)ccc1O
InChIInChI=1S/C15H15FO/c1-2-3-13-10-12(6-9-15(13)17)11-4-7-14(16)8-5-11/h4-10,17H,2-3H2,1H3
InChIKeyVLVAINRVXJSXMV-UHFFFAOYSA-N
XLogP4.15
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.28
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-2-propylphenol?
The IUPAC name of 4-(4-fluorophenyl)-2-propylphenol (CID 22458869) is 4-(4-fluorophenyl)-2-propylphenol.
What is the SMILES notation for 4-(4-fluorophenyl)-2-propylphenol?
The canonical SMILES for 4-(4-fluorophenyl)-2-propylphenol is CCCc1cc(-c2ccc(F)cc2)ccc1O.
What is the InChIKey of 4-(4-fluorophenyl)-2-propylphenol?
The InChIKey is VLVAINRVXJSXMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FO/c1-2-3-13-10-12(6-9-15(13)17)11-4-7-14(16)8-5-11/h4-10,17H,2-3H2,1H3.
What are the key properties of 4-(4-fluorophenyl)-2-propylphenol?
4-(4-fluorophenyl)-2-propylphenol has a molecular weight of 230.28 g/mol, XLogP of 4.15, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-2-propylphenol is sourced from PubChem (CID 22458869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).