4-ethenyl-2-ethoxy-1-propan-2-yloxybenzene

C13H18O2 — CID 118269443

IUPAC4-ethenyl-2-ethoxy-1-propan-2-yloxybenzene
SMILESC=Cc1ccc(OC(C)C)c(OCC)c1
InChIInChI=1S/C13H18O2/c1-5-11-7-8-12(15-10(3)4)13(9-11)14-6-2/h5,7-10H,1,6H2,2-4H3
InChIKeyVQGBFUXDPHLRFT-UHFFFAOYSA-N
MW206.28 g/mol
LogP3.52
Rot. Bonds5

About 4-ethenyl-2-ethoxy-1-propan-2-yloxybenzene

4-ethenyl-2-ethoxy-1-propan-2-yloxybenzene (PubChem CID 118269443) has the molecular formula C13H18O2 and a molecular weight of 206.28 g/mol. Its IUPAC name is 4-ethenyl-2-ethoxy-1-propan-2-yloxybenzene.

Molecular Properties

Compound Name4-ethenyl-2-ethoxy-1-propan-2-yloxybenzene
PubChem CID118269443
Molecular FormulaC13H18O2
Molecular Weight206.28 g/mol
Exact Mass206.13
IUPAC Name4-ethenyl-2-ethoxy-1-propan-2-yloxybenzene
SMILESC=Cc1ccc(OC(C)C)c(OCC)c1
InChIInChI=1S/C13H18O2/c1-5-11-7-8-12(15-10(3)4)13(9-11)14-6-2/h5,7-10H,1,6H2,2-4H3
InChIKeyVQGBFUXDPHLRFT-UHFFFAOYSA-N
XLogP3.52
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.28
LogP ≤ 53.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(3-ethoxy-4-propan-2-yloxyphenyl)methylidenehydrazine
CID 168529586
4-ethenyl-2-ethoxy-1-methoxybenzene
CID 11665489
5-[(3-ethoxy-4-propan-2-yloxyphenyl)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione
CID 168597869
(E)-3-(3-ethoxy-4-propan-2-yloxyphenyl)prop-2-enehydrazide
CID 91684434
1-[(E)-(3-ethoxy-4-propan-2-yloxyphenyl)methylideneamino]-3-prop-2-enylthiourea
CID 110341327
1-(chloromethyl)-4-ethenyl-2-ethoxybenzene
CID 89427722
(5Z)-5-[(3-ethoxy-4-propan-2-yloxyphenyl)methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
CID 126354435
2-cyano-3-(3-ethoxy-4-propan-2-yloxyphenyl)prop-2-enethioamide
CID 3511020
(E)-3-(3-ethoxy-4-propan-2-yloxyphenyl)-1-(4-methylphenyl)prop-2-en-1-one
CID 82185610
3-ethoxy-N-propan-2-yl-4-propan-2-yloxyaniline
CID 83952039
2-[(4-ethenyl-2-ethoxyphenoxy)methoxy]ethyl-trimethylsilane
CID 168749605
N-[(E)-(3-ethoxy-4-propan-2-yloxyphenyl)methylideneamino]pentanamide
CID 110506843

Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-2-ethoxy-1-propan-2-yloxybenzene?
The IUPAC name of 4-ethenyl-2-ethoxy-1-propan-2-yloxybenzene (CID 118269443) is 4-ethenyl-2-ethoxy-1-propan-2-yloxybenzene.
What is the SMILES notation for 4-ethenyl-2-ethoxy-1-propan-2-yloxybenzene?
The canonical SMILES for 4-ethenyl-2-ethoxy-1-propan-2-yloxybenzene is C=Cc1ccc(OC(C)C)c(OCC)c1.
What is the InChIKey of 4-ethenyl-2-ethoxy-1-propan-2-yloxybenzene?
The InChIKey is VQGBFUXDPHLRFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18O2/c1-5-11-7-8-12(15-10(3)4)13(9-11)14-6-2/h5,7-10H,1,6H2,2-4H3.
What are the key properties of 4-ethenyl-2-ethoxy-1-propan-2-yloxybenzene?
4-ethenyl-2-ethoxy-1-propan-2-yloxybenzene has a molecular weight of 206.28 g/mol, XLogP of 3.52, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-2-ethoxy-1-propan-2-yloxybenzene is sourced from PubChem (CID 118269443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).