1-(2-prop-2-enylphenyl)ethanol

C11H14O — CID 10749513

IUPAC1-(2-prop-2-enylphenyl)ethanol
SMILESC=CCc1ccccc1C(C)O
InChIInChI=1S/C11H14O/c1-3-6-10-7-4-5-8-11(10)9(2)12/h3-5,7-9,12H,1,6H2,2H3
InChIKeyZRXLPSBWHIJZMC-UHFFFAOYSA-N
MW162.23 g/mol
LogP2.47
Rot. Bonds3

About 1-(2-prop-2-enylphenyl)ethanol

1-(2-prop-2-enylphenyl)ethanol (PubChem CID 10749513) has the molecular formula C11H14O and a molecular weight of 162.23 g/mol. Its IUPAC name is 1-(2-prop-2-enylphenyl)ethanol.

Molecular Properties

Compound Name1-(2-prop-2-enylphenyl)ethanol
PubChem CID10749513
Molecular FormulaC11H14O
Molecular Weight162.23 g/mol
Exact Mass162.10
IUPAC Name1-(2-prop-2-enylphenyl)ethanol
SMILESC=CCc1ccccc1C(C)O
InChIInChI=1S/C11H14O/c1-3-6-10-7-4-5-8-11(10)9(2)12/h3-5,7-9,12H,1,6H2,2H3
InChIKeyZRXLPSBWHIJZMC-UHFFFAOYSA-N
XLogP2.47
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.23
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

carbon monoxide;chromium;N,N-dimethyl-1-(2-prop-2-enylphenyl)ethanamine
CID 134884111
ethanol;1-(2-ethylphenyl)ethanol
CID 174807968
1-(2-prop-2-enylphenyl)ethylphosphanyl acetate
CID 143547500
cyclohexyl-(2-prop-2-enylphenyl)methanol
CID 102302622
1,2-bis(prop-2-enyl)benzene;formic acid
CID 174684610
1-(2-prop-2-enylphenoxy)propan-1-ol
CID 70371312
1-(2-prop-2-enylphenyl)prop-2-ene-1-sulfonamide
CID 173333425
1-methyl-2-prop-2-enylbenzene;sulfane
CID 174918280
methane;1-methyl-2-prop-2-enylbenzene
CID 174365033
1-prop-2-enyl-2-propylbenzene
CID 12585186
1-(2-methylpropylsulfanyl)-2-prop-2-enylbenzene
CID 91655457
2-propan-2-ylphenol;prop-2-enylbenzene
CID 175237789

Frequently Asked Questions

What is the IUPAC name of 1-(2-prop-2-enylphenyl)ethanol?
The IUPAC name of 1-(2-prop-2-enylphenyl)ethanol (CID 10749513) is 1-(2-prop-2-enylphenyl)ethanol.
What is the SMILES notation for 1-(2-prop-2-enylphenyl)ethanol?
The canonical SMILES for 1-(2-prop-2-enylphenyl)ethanol is C=CCc1ccccc1C(C)O.
What is the InChIKey of 1-(2-prop-2-enylphenyl)ethanol?
The InChIKey is ZRXLPSBWHIJZMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O/c1-3-6-10-7-4-5-8-11(10)9(2)12/h3-5,7-9,12H,1,6H2,2H3.
What are the key properties of 1-(2-prop-2-enylphenyl)ethanol?
1-(2-prop-2-enylphenyl)ethanol has a molecular weight of 162.23 g/mol, XLogP of 2.47, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-prop-2-enylphenyl)ethanol is sourced from PubChem (CID 10749513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).