1-methoxy-4-[2-(4-methoxy-3-prop-2-enylphenyl)propan-2-yl]-2-prop-2-enylbenzene

C23H28O2 — CID 19042683

IUPAC1-methoxy-4-[2-(4-methoxy-3-prop-2-enylphenyl)propan-2-yl]-2-prop-2-enylbenzene
SMILESC=CCc1cc(C(C)(C)c2ccc(OC)c(CC=C)c2)ccc1OC
InChIInChI=1S/C23H28O2/c1-7-9-17-15-19(11-13-21(17)24-5)23(3,4)20-12-14-22(25-6)18(16-20)10-8-2/h7-8,11-16H,1-2,9-10H2,3-6H3
InChIKeyYJBOZIJFBVOJFA-UHFFFAOYSA-N
MW336.48 g/mol
LogP5.49
Rot. Bonds8

About 1-methoxy-4-[2-(4-methoxy-3-prop-2-enylphenyl)propan-2-yl]-2-prop-2-enylbenzene

1-methoxy-4-[2-(4-methoxy-3-prop-2-enylphenyl)propan-2-yl]-2-prop-2-enylbenzene (PubChem CID 19042683) has the molecular formula C23H28O2 and a molecular weight of 336.48 g/mol. Its IUPAC name is 1-methoxy-4-[2-(4-methoxy-3-prop-2-enylphenyl)propan-2-yl]-2-prop-2-enylbenzene.

Molecular Properties

Compound Name1-methoxy-4-[2-(4-methoxy-3-prop-2-enylphenyl)propan-2-yl]-2-prop-2-enylbenzene
PubChem CID19042683
Molecular FormulaC23H28O2
Molecular Weight336.48 g/mol
Exact Mass336.21
IUPAC Name1-methoxy-4-[2-(4-methoxy-3-prop-2-enylphenyl)propan-2-yl]-2-prop-2-enylbenzene
SMILESC=CCc1cc(C(C)(C)c2ccc(OC)c(CC=C)c2)ccc1OC
InChIInChI=1S/C23H28O2/c1-7-9-17-15-19(11-13-21(17)24-5)23(3,4)20-12-14-22(25-6)18(16-20)10-8-2/h7-8,11-16H,1-2,9-10H2,3-6H3
InChIKeyYJBOZIJFBVOJFA-UHFFFAOYSA-N
XLogP5.49
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.48
LogP ≤ 55.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

[4-[2-(4-acetyloxy-3-prop-2-enylphenyl)propan-2-yl]-2-prop-2-enylphenyl] acetate;ethane
CID 145491393
1-(2-methoxyethoxy)-4-[2-(4-methyl-3-prop-2-enylphenyl)propan-2-yl]-2-prop-2-enylbenzene
CID 144907753
1-methoxy-4-(4-methoxy-3-prop-2-enylphenoxy)-2-prop-2-enylbenzene
CID 144777892
4-[2-(4-carboxy-3-prop-2-enylphenyl)propan-2-yl]-2-prop-2-enylbenzoic acid
CID 139984801
[4-[2-(4-isocyanooxy-3-prop-2-enylphenyl)propan-2-yl]-2-prop-2-enylphenyl] cyanate
CID 176753434
1-methoxy-4-(methoxymethyl)-2-prop-2-enylbenzene
CID 59727862
2-(bromomethyl)-4-[2-[3-(bromomethyl)-4-methoxyphenyl]propan-2-yl]-1-methylbenzene
CID 20821575
1-[4-(4-methoxyphenyl)sulfonylphenoxy]-4-[2-[4-[4-[4-[4-[2-(4-methylphenyl)propan-2-yl]phenoxy]phenyl]sulfonylphenoxy]-3-prop-2-enylphenyl]propan-2-yl]-2-prop-2-enylbenzene
CID 59409169
2-[[4-[2-[4-[1,1-bis[4-(oxiran-2-ylmethoxy)-3-prop-2-enylphenyl]ethyl]phenyl]propan-2-yl]-2-prop-2-enylphenoxy]methyl]oxirane
CID 130209636
anisole;1,3-dimethoxybenzene;1,4-dimethoxybenzene;ethane;methoxymethane;1-methoxy-4-[(4-methoxyphenyl)methyl]benzene;1-methoxy-4-[2-(4-methoxy-3-prop-2-enylphenyl)propan-2-yl]-2-prop-2-enylbenzene;1-methoxy-4-[2-(4-methylphenyl)propan-2-yl]benzene;(2-methoxyphenyl)methanol
CID 157202511
4-methoxy-1-[(2-methylpropan-2-yl)oxy]-2-prop-2-enylbenzene
CID 129010804
1-O-methyl 3-O-[4-[2-(4-methyl-3-prop-2-enylphenyl)propan-2-yl]-2-prop-2-enylphenyl] benzene-1,3-dicarboxylate
CID 22898031

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-4-[2-(4-methoxy-3-prop-2-enylphenyl)propan-2-yl]-2-prop-2-enylbenzene?
The IUPAC name of 1-methoxy-4-[2-(4-methoxy-3-prop-2-enylphenyl)propan-2-yl]-2-prop-2-enylbenzene (CID 19042683) is 1-methoxy-4-[2-(4-methoxy-3-prop-2-enylphenyl)propan-2-yl]-2-prop-2-enylbenzene.
What is the SMILES notation for 1-methoxy-4-[2-(4-methoxy-3-prop-2-enylphenyl)propan-2-yl]-2-prop-2-enylbenzene?
The canonical SMILES for 1-methoxy-4-[2-(4-methoxy-3-prop-2-enylphenyl)propan-2-yl]-2-prop-2-enylbenzene is C=CCc1cc(C(C)(C)c2ccc(OC)c(CC=C)c2)ccc1OC.
What is the InChIKey of 1-methoxy-4-[2-(4-methoxy-3-prop-2-enylphenyl)propan-2-yl]-2-prop-2-enylbenzene?
The InChIKey is YJBOZIJFBVOJFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28O2/c1-7-9-17-15-19(11-13-21(17)24-5)23(3,4)20-12-14-22(25-6)18(16-20)10-8-2/h7-8,11-16H,1-2,9-10H2,3-6H3.
What are the key properties of 1-methoxy-4-[2-(4-methoxy-3-prop-2-enylphenyl)propan-2-yl]-2-prop-2-enylbenzene?
1-methoxy-4-[2-(4-methoxy-3-prop-2-enylphenyl)propan-2-yl]-2-prop-2-enylbenzene has a molecular weight of 336.48 g/mol, XLogP of 5.49, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-4-[2-(4-methoxy-3-prop-2-enylphenyl)propan-2-yl]-2-prop-2-enylbenzene is sourced from PubChem (CID 19042683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).