4-prop-2-enoxy-2-prop-2-enylphenol

C12H14O2 — CID 45091477

IUPAC4-prop-2-enoxy-2-prop-2-enylphenol
SMILESC=CCOc1ccc(O)c(CC=C)c1
InChIInChI=1S/C12H14O2/c1-3-5-10-9-11(14-8-4-2)6-7-12(10)13/h3-4,6-7,9,13H,1-2,5,8H2
InChIKeyJEWGSRVWGHNBQF-UHFFFAOYSA-N
MW190.24 g/mol
LogP2.69
Rot. Bonds5

About 4-prop-2-enoxy-2-prop-2-enylphenol

4-prop-2-enoxy-2-prop-2-enylphenol (PubChem CID 45091477) has the molecular formula C12H14O2 and a molecular weight of 190.24 g/mol. Its IUPAC name is 4-prop-2-enoxy-2-prop-2-enylphenol.

Molecular Properties

Compound Name4-prop-2-enoxy-2-prop-2-enylphenol
PubChem CID45091477
Molecular FormulaC12H14O2
Molecular Weight190.24 g/mol
Exact Mass190.10
IUPAC Name4-prop-2-enoxy-2-prop-2-enylphenol
SMILESC=CCOc1ccc(O)c(CC=C)c1
InChIInChI=1S/C12H14O2/c1-3-5-10-9-11(14-8-4-2)6-7-12(10)13/h3-4,6-7,9,13H,1-2,5,8H2
InChIKeyJEWGSRVWGHNBQF-UHFFFAOYSA-N
XLogP2.69
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.24
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-(3-methylbutoxy)-2-prop-2-enylphenol
CID 24770421
4-hexoxy-2-prop-2-enylphenol;methane
CID 70388285
2-fluoro-4-prop-2-enoxyphenol
CID 169297964
(2-hydroxy-5-prop-2-enoxyphenyl)methylazanium acetate
CID 154662720
4-(4-methoxyphenyl)-2-prop-2-enylphenol
CID 54757995
4-ethoxy-1-prop-2-enoxy-2-prop-2-enylbenzene
CID 24770219
phenol;4-phenoxy-2-prop-2-enylphenol;2-prop-2-enylphenol
CID 157279728
4-(4-hydroxyphenyl)-2-prop-2-enylphenol
CID 70597664
dipotassium;3-bromoprop-1-ene;hydride;4-[4-hydroxy-3,5-bis(prop-2-enyl)phenoxy]-2,6-bis(prop-2-enyl)phenol;4-(4-hydroxy-3-prop-2-enylphenoxy)-2-prop-2-enylphenol;oxido formate;1-prop-2-enoxy-4-(4-prop-2-enoxy-3-prop-2-enylphenoxy)-2-prop-2-enylbenzene
CID 158938704
4-[(E)-3-hydroxyprop-1-enyl]-2-prop-2-enylphenol
CID 12641154
dipotassium;3-bromoprop-1-ene;4-[1,1,1,3,3,3-hexafluoro-2-(4-hydroxyphenyl)propan-2-yl]phenol;4-[1,1,1,3,3,3-hexafluoro-2-(4-hydroxy-3-prop-2-enylphenyl)propan-2-yl]-2-prop-2-enylphenol;bis(1-[1,1,1,3,3,3-hexafluoro-2-(4-prop-2-enoxyphenyl)propan-2-yl]-4-prop-2-enoxybenzene);hydride;oxido formate
CID 159169502
4-phenylmethoxy-1-prop-2-enoxy-2-prop-2-enylbenzene
CID 22261130

Frequently Asked Questions

What is the IUPAC name of 4-prop-2-enoxy-2-prop-2-enylphenol?
The IUPAC name of 4-prop-2-enoxy-2-prop-2-enylphenol (CID 45091477) is 4-prop-2-enoxy-2-prop-2-enylphenol.
What is the SMILES notation for 4-prop-2-enoxy-2-prop-2-enylphenol?
The canonical SMILES for 4-prop-2-enoxy-2-prop-2-enylphenol is C=CCOc1ccc(O)c(CC=C)c1.
What is the InChIKey of 4-prop-2-enoxy-2-prop-2-enylphenol?
The InChIKey is JEWGSRVWGHNBQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14O2/c1-3-5-10-9-11(14-8-4-2)6-7-12(10)13/h3-4,6-7,9,13H,1-2,5,8H2.
What are the key properties of 4-prop-2-enoxy-2-prop-2-enylphenol?
4-prop-2-enoxy-2-prop-2-enylphenol has a molecular weight of 190.24 g/mol, XLogP of 2.69, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-prop-2-enoxy-2-prop-2-enylphenol is sourced from PubChem (CID 45091477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).