2-[(Z)-3-phenylprop-2-enoxy]ethanol

C11H14O2 — CID 11679907

IUPAC2-[(Z)-3-phenylprop-2-enoxy]ethanol
SMILESOCCOC/C=C\c1ccccc1
InChIInChI=1S/C11H14O2/c12-8-10-13-9-4-7-11-5-2-1-3-6-11/h1-7,12H,8-10H2/b7-4-
InChIKeyVESSUVYGYNWKQE-DAXSKMNVSA-N
MW178.23 g/mol
LogP1.71
Rot. Bonds5

About 2-[(Z)-3-phenylprop-2-enoxy]ethanol

2-[(Z)-3-phenylprop-2-enoxy]ethanol (PubChem CID 11679907) has the molecular formula C11H14O2 and a molecular weight of 178.23 g/mol. Its IUPAC name is 2-[(Z)-3-phenylprop-2-enoxy]ethanol.

Molecular Properties

Compound Name2-[(Z)-3-phenylprop-2-enoxy]ethanol
PubChem CID11679907
Molecular FormulaC11H14O2
Molecular Weight178.23 g/mol
Exact Mass178.10
IUPAC Name2-[(Z)-3-phenylprop-2-enoxy]ethanol
SMILESOCCOC/C=C\c1ccccc1
InChIInChI=1S/C11H14O2/c12-8-10-13-9-4-7-11-5-2-1-3-6-11/h1-7,12H,8-10H2/b7-4-
InChIKeyVESSUVYGYNWKQE-DAXSKMNVSA-N
XLogP1.71
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

[(E)-3-[4-[(E)-3-phenylprop-2-enoxy]butoxy]prop-1-enyl]benzene
CID 15531171
3-(2-bromoethoxy)prop-1-enylbenzene
CID 72731799
3-[(E)-3-phenylprop-2-enoxy]propanenitrile
CID 43128812
3-nonoxyprop-1-enylbenzene
CID 91487084
5-(3-phenylprop-2-enoxy)pentan-1-amine
CID 76943765
3-henicosoxyprop-1-enylbenzene
CID 139660432
[(E)-3-[(E)-4-iodobut-2-enoxy]prop-1-enyl]benzene
CID 135085265
N,N-dimethyl-2-[(E)-3-phenylprop-2-enoxy]ethanamine;oxalic acid
CID 70686302
[(E)-3-[(Z)-6-phenylhex-3-enoxy]prop-1-enyl]benzene
CID 56957260
[(1E)-5-phenylpenta-1,4-dienyl]benzene
CID 91021368
1,3,5-tris[[(E)-3-phenylprop-2-enoxy]methyl]benzene
CID 15531172
1-(3-phenylprop-2-enoxy)propan-2-ol
CID 70377991

Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-3-phenylprop-2-enoxy]ethanol?
The IUPAC name of 2-[(Z)-3-phenylprop-2-enoxy]ethanol (CID 11679907) is 2-[(Z)-3-phenylprop-2-enoxy]ethanol.
What is the SMILES notation for 2-[(Z)-3-phenylprop-2-enoxy]ethanol?
The canonical SMILES for 2-[(Z)-3-phenylprop-2-enoxy]ethanol is OCCOC/C=C\c1ccccc1.
What is the InChIKey of 2-[(Z)-3-phenylprop-2-enoxy]ethanol?
The InChIKey is VESSUVYGYNWKQE-DAXSKMNVSA-N. The full InChI is InChI=1S/C11H14O2/c12-8-10-13-9-4-7-11-5-2-1-3-6-11/h1-7,12H,8-10H2/b7-4-.
What are the key properties of 2-[(Z)-3-phenylprop-2-enoxy]ethanol?
2-[(Z)-3-phenylprop-2-enoxy]ethanol has a molecular weight of 178.23 g/mol, XLogP of 1.71, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-3-phenylprop-2-enoxy]ethanol is sourced from PubChem (CID 11679907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).