2-ethenyl-4-(1-hydroxy-1-phenylpropyl)phenol

C17H18O2 — CID 143545360

IUPAC2-ethenyl-4-(1-hydroxy-1-phenylpropyl)phenol
SMILESC=Cc1cc(C(O)(CC)c2ccccc2)ccc1O
InChIInChI=1S/C17H18O2/c1-3-13-12-15(10-11-16(13)18)17(19,4-2)14-8-6-5-7-9-14/h3,5-12,18-19H,1,4H2,2H3
InChIKeyDCNRHOZUBTVZHN-UHFFFAOYSA-N
MW254.33 g/mol
LogP3.68
Rot. Bonds4

About 2-ethenyl-4-(1-hydroxy-1-phenylpropyl)phenol

2-ethenyl-4-(1-hydroxy-1-phenylpropyl)phenol (PubChem CID 143545360) has the molecular formula C17H18O2 and a molecular weight of 254.33 g/mol. Its IUPAC name is 2-ethenyl-4-(1-hydroxy-1-phenylpropyl)phenol.

Molecular Properties

Compound Name2-ethenyl-4-(1-hydroxy-1-phenylpropyl)phenol
PubChem CID143545360
Molecular FormulaC17H18O2
Molecular Weight254.33 g/mol
Exact Mass254.13
IUPAC Name2-ethenyl-4-(1-hydroxy-1-phenylpropyl)phenol
SMILESC=Cc1cc(C(O)(CC)c2ccccc2)ccc1O
InChIInChI=1S/C17H18O2/c1-3-13-12-15(10-11-16(13)18)17(19,4-2)14-8-6-5-7-9-14/h3,5-12,18-19H,1,4H2,2H3
InChIKeyDCNRHOZUBTVZHN-UHFFFAOYSA-N
XLogP3.68
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 53.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-4-(1-hydroxy-1-phenylpropyl)phenol?
The IUPAC name of 2-ethenyl-4-(1-hydroxy-1-phenylpropyl)phenol (CID 143545360) is 2-ethenyl-4-(1-hydroxy-1-phenylpropyl)phenol.
What is the SMILES notation for 2-ethenyl-4-(1-hydroxy-1-phenylpropyl)phenol?
The canonical SMILES for 2-ethenyl-4-(1-hydroxy-1-phenylpropyl)phenol is C=Cc1cc(C(O)(CC)c2ccccc2)ccc1O.
What is the InChIKey of 2-ethenyl-4-(1-hydroxy-1-phenylpropyl)phenol?
The InChIKey is DCNRHOZUBTVZHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18O2/c1-3-13-12-15(10-11-16(13)18)17(19,4-2)14-8-6-5-7-9-14/h3,5-12,18-19H,1,4H2,2H3.
What are the key properties of 2-ethenyl-4-(1-hydroxy-1-phenylpropyl)phenol?
2-ethenyl-4-(1-hydroxy-1-phenylpropyl)phenol has a molecular weight of 254.33 g/mol, XLogP of 3.68, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-4-(1-hydroxy-1-phenylpropyl)phenol is sourced from PubChem (CID 143545360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).