1-[4-ethenyl-2-(1-hydroxyethyl)phenyl]ethanol

C12H16O2 — CID 164846178

IUPAC1-[4-ethenyl-2-(1-hydroxyethyl)phenyl]ethanol
SMILESC=Cc1ccc(C(C)O)c(C(C)O)c1
InChIInChI=1S/C12H16O2/c1-4-10-5-6-11(8(2)13)12(7-10)9(3)14/h4-9,13-14H,1H2,2-3H3
InChIKeyWVMXVOVLCWWULW-UHFFFAOYSA-N
MW192.26 g/mol
LogP2.44
Rot. Bonds3

About 1-[4-ethenyl-2-(1-hydroxyethyl)phenyl]ethanol

1-[4-ethenyl-2-(1-hydroxyethyl)phenyl]ethanol (PubChem CID 164846178) has the molecular formula C12H16O2 and a molecular weight of 192.26 g/mol. Its IUPAC name is 1-[4-ethenyl-2-(1-hydroxyethyl)phenyl]ethanol.

Molecular Properties

Compound Name1-[4-ethenyl-2-(1-hydroxyethyl)phenyl]ethanol
PubChem CID164846178
Molecular FormulaC12H16O2
Molecular Weight192.26 g/mol
Exact Mass192.12
IUPAC Name1-[4-ethenyl-2-(1-hydroxyethyl)phenyl]ethanol
SMILESC=Cc1ccc(C(C)O)c(C(C)O)c1
InChIInChI=1S/C12H16O2/c1-4-10-5-6-11(8(2)13)12(7-10)9(3)14/h4-9,13-14H,1H2,2-3H3
InChIKeyWVMXVOVLCWWULW-UHFFFAOYSA-N
XLogP2.44
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[4-ethenyl-2-(1-hydroxyethyl)phenyl]ethanol?
The IUPAC name of 1-[4-ethenyl-2-(1-hydroxyethyl)phenyl]ethanol (CID 164846178) is 1-[4-ethenyl-2-(1-hydroxyethyl)phenyl]ethanol.
What is the SMILES notation for 1-[4-ethenyl-2-(1-hydroxyethyl)phenyl]ethanol?
The canonical SMILES for 1-[4-ethenyl-2-(1-hydroxyethyl)phenyl]ethanol is C=Cc1ccc(C(C)O)c(C(C)O)c1.
What is the InChIKey of 1-[4-ethenyl-2-(1-hydroxyethyl)phenyl]ethanol?
The InChIKey is WVMXVOVLCWWULW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16O2/c1-4-10-5-6-11(8(2)13)12(7-10)9(3)14/h4-9,13-14H,1H2,2-3H3.
What are the key properties of 1-[4-ethenyl-2-(1-hydroxyethyl)phenyl]ethanol?
1-[4-ethenyl-2-(1-hydroxyethyl)phenyl]ethanol has a molecular weight of 192.26 g/mol, XLogP of 2.44, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-ethenyl-2-(1-hydroxyethyl)phenyl]ethanol is sourced from PubChem (CID 164846178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).