4-[1-(4-hydroxyphenyl)propyl]-2-propylphenol

C18H22O2 — CID 68583785

IUPAC4-[1-(4-hydroxyphenyl)propyl]-2-propylphenol
SMILESCCCc1cc(C(CC)c2ccc(O)cc2)ccc1O
InChIInChI=1S/C18H22O2/c1-3-5-15-12-14(8-11-18(15)20)17(4-2)13-6-9-16(19)10-7-13/h6-12,17,19-20H,3-5H2,1-2H3
InChIKeyNCWCSGBVFWKHIU-UHFFFAOYSA-N
MW270.37 g/mol
LogP4.59
Rot. Bonds5

About 4-[1-(4-hydroxyphenyl)propyl]-2-propylphenol

4-[1-(4-hydroxyphenyl)propyl]-2-propylphenol (PubChem CID 68583785) has the molecular formula C18H22O2 and a molecular weight of 270.37 g/mol. Its IUPAC name is 4-[1-(4-hydroxyphenyl)propyl]-2-propylphenol.

Molecular Properties

Compound Name4-[1-(4-hydroxyphenyl)propyl]-2-propylphenol
PubChem CID68583785
Molecular FormulaC18H22O2
Molecular Weight270.37 g/mol
Exact Mass270.16
IUPAC Name4-[1-(4-hydroxyphenyl)propyl]-2-propylphenol
SMILESCCCc1cc(C(CC)c2ccc(O)cc2)ccc1O
InChIInChI=1S/C18H22O2/c1-3-5-15-12-14(8-11-18(15)20)17(4-2)13-6-9-16(19)10-7-13/h6-12,17,19-20H,3-5H2,1-2H3
InChIKeyNCWCSGBVFWKHIU-UHFFFAOYSA-N
XLogP4.59
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 54.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-[1-(4-hydroxy-3-propylphenyl)tetradecyl]-2-propylphenol
CID 172551030
4-[bis(4-hydroxy-3-propylphenyl)methyl]benzene-1,2-diol
CID 67315319
4-[1-(4-hydroxyphenyl)propyl]phenol;undecane
CID 174905836
4-[1-(4-hydroxyphenyl)propyl]-2-(trifluoromethyl)phenol
CID 150882903
2-[1-(4-hydroxyphenyl)propyl]benzene-1,3,5-triol
CID 118174328
4-[1-(4-hydroxy-3-nonylphenyl)nonyl]-2-nonylphenol
CID 135345643
2-ethyl-4-[1-(3-ethyl-4-hydroxyphenyl)butyl]phenol
CID 139671739
4-[1-(4-hydroxy-3-propan-2-ylphenyl)propyl]-2-propan-2-ylphenol
CID 19352790
4-[4-(4-hydroxy-3-propylphenyl)heptan-4-yl]-2-propylphenol
CID 71712434
4-[1-[4-[3-(1-phenylpropyl)phenoxy]phenyl]propyl]phenol
CID 143290824
2-bromo-5-(1-phenylpropyl)-4-propylphenol
CID 171562921
4-(4-fluorophenyl)-2-propylphenol
CID 22458869

Frequently Asked Questions

What is the IUPAC name of 4-[1-(4-hydroxyphenyl)propyl]-2-propylphenol?
The IUPAC name of 4-[1-(4-hydroxyphenyl)propyl]-2-propylphenol (CID 68583785) is 4-[1-(4-hydroxyphenyl)propyl]-2-propylphenol.
What is the SMILES notation for 4-[1-(4-hydroxyphenyl)propyl]-2-propylphenol?
The canonical SMILES for 4-[1-(4-hydroxyphenyl)propyl]-2-propylphenol is CCCc1cc(C(CC)c2ccc(O)cc2)ccc1O.
What is the InChIKey of 4-[1-(4-hydroxyphenyl)propyl]-2-propylphenol?
The InChIKey is NCWCSGBVFWKHIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22O2/c1-3-5-15-12-14(8-11-18(15)20)17(4-2)13-6-9-16(19)10-7-13/h6-12,17,19-20H,3-5H2,1-2H3.
What are the key properties of 4-[1-(4-hydroxyphenyl)propyl]-2-propylphenol?
4-[1-(4-hydroxyphenyl)propyl]-2-propylphenol has a molecular weight of 270.37 g/mol, XLogP of 4.59, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(4-hydroxyphenyl)propyl]-2-propylphenol is sourced from PubChem (CID 68583785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).