4-ethenoxy-1-[2-(4-ethenoxy-2-ethoxyphenyl)propan-2-yl]-2-ethoxybenzene

C23H28O4 — CID 67789753

IUPAC4-ethenoxy-1-[2-(4-ethenoxy-2-ethoxyphenyl)propan-2-yl]-2-ethoxybenzene
SMILESC=COc1ccc(C(C)(C)c2ccc(OC=C)cc2OCC)c(OCC)c1
InChIInChI=1S/C23H28O4/c1-7-24-17-11-13-19(21(15-17)26-9-3)23(5,6)20-14-12-18(25-8-2)16-22(20)27-10-4/h7-8,11-16H,1-2,9-10H2,3-6H3
InChIKeyHQZJWJSLKYZOQT-UHFFFAOYSA-N
MW368.47 g/mol
LogP5.85
Rot. Bonds10

About 4-ethenoxy-1-[2-(4-ethenoxy-2-ethoxyphenyl)propan-2-yl]-2-ethoxybenzene

4-ethenoxy-1-[2-(4-ethenoxy-2-ethoxyphenyl)propan-2-yl]-2-ethoxybenzene (PubChem CID 67789753) has the molecular formula C23H28O4 and a molecular weight of 368.47 g/mol. Its IUPAC name is 4-ethenoxy-1-[2-(4-ethenoxy-2-ethoxyphenyl)propan-2-yl]-2-ethoxybenzene.

Molecular Properties

Compound Name4-ethenoxy-1-[2-(4-ethenoxy-2-ethoxyphenyl)propan-2-yl]-2-ethoxybenzene
PubChem CID67789753
Molecular FormulaC23H28O4
Molecular Weight368.47 g/mol
Exact Mass368.20
IUPAC Name4-ethenoxy-1-[2-(4-ethenoxy-2-ethoxyphenyl)propan-2-yl]-2-ethoxybenzene
SMILESC=COc1ccc(C(C)(C)c2ccc(OC=C)cc2OCC)c(OCC)c1
InChIInChI=1S/C23H28O4/c1-7-24-17-11-13-19(21(15-17)26-9-3)23(5,6)20-14-12-18(25-8-2)16-22(20)27-10-4/h7-8,11-16H,1-2,9-10H2,3-6H3
InChIKeyHQZJWJSLKYZOQT-UHFFFAOYSA-N
XLogP5.85
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.47
LogP ≤ 55.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

[3-ethoxy-4-[2-[2-ethoxy-4-(2-methylprop-2-enoyloxy)phenyl]propan-2-yl]phenyl] 2-methylprop-2-enoate
CID 24821962
1-[5-but-1-enoxy-2-[2-[4-but-1-enoxy-2-(2-hydroxypropoxy)phenyl]propan-2-yl]phenoxy]propan-2-ol
CID 151787402
1,4-diethoxy-2-prop-2-enylbenzene
CID 24770734
1-prop-2-enoxy-2-[2-(2-prop-2-enoxyphenyl)propan-2-yl]benzene
CID 121396887
2,3-dibromo-1-[2-(2,3-dibromo-4-ethoxyphenyl)propan-2-yl]-4-ethoxybenzene
CID 54514286
[4-[2-[4-(2-methylprop-2-enoyloxy)-2-propoxyphenyl]propan-2-yl]-3-propoxyphenyl] 2-methylprop-2-enoate
CID 70366856
1,4-bis(ethenoxy)benzene;ethane
CID 145326219
[6-[2-(3,4-diethoxy-2-prop-2-enoyloxyphenyl)propan-2-yl]-2,3-diethoxyphenyl] prop-2-enoate
CID 67764266
4-ethoxy-2-methoxy-1-prop-2-enylbenzene
CID 24770498
(2,5-diethoxyphenyl) prop-2-enoate
CID 174805229
4-ethoxy-1-prop-2-enoxy-2-prop-2-enylbenzene
CID 24770219
1,4-bis(ethenoxy)-2-ethenylbenzene
CID 174997076

Frequently Asked Questions

What is the IUPAC name of 4-ethenoxy-1-[2-(4-ethenoxy-2-ethoxyphenyl)propan-2-yl]-2-ethoxybenzene?
The IUPAC name of 4-ethenoxy-1-[2-(4-ethenoxy-2-ethoxyphenyl)propan-2-yl]-2-ethoxybenzene (CID 67789753) is 4-ethenoxy-1-[2-(4-ethenoxy-2-ethoxyphenyl)propan-2-yl]-2-ethoxybenzene.
What is the SMILES notation for 4-ethenoxy-1-[2-(4-ethenoxy-2-ethoxyphenyl)propan-2-yl]-2-ethoxybenzene?
The canonical SMILES for 4-ethenoxy-1-[2-(4-ethenoxy-2-ethoxyphenyl)propan-2-yl]-2-ethoxybenzene is C=COc1ccc(C(C)(C)c2ccc(OC=C)cc2OCC)c(OCC)c1.
What is the InChIKey of 4-ethenoxy-1-[2-(4-ethenoxy-2-ethoxyphenyl)propan-2-yl]-2-ethoxybenzene?
The InChIKey is HQZJWJSLKYZOQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28O4/c1-7-24-17-11-13-19(21(15-17)26-9-3)23(5,6)20-14-12-18(25-8-2)16-22(20)27-10-4/h7-8,11-16H,1-2,9-10H2,3-6H3.
What are the key properties of 4-ethenoxy-1-[2-(4-ethenoxy-2-ethoxyphenyl)propan-2-yl]-2-ethoxybenzene?
4-ethenoxy-1-[2-(4-ethenoxy-2-ethoxyphenyl)propan-2-yl]-2-ethoxybenzene has a molecular weight of 368.47 g/mol, XLogP of 5.85, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenoxy-1-[2-(4-ethenoxy-2-ethoxyphenyl)propan-2-yl]-2-ethoxybenzene is sourced from PubChem (CID 67789753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).