5-(4-ethenylphenoxy)-1,2,3-trimethoxybenzene

C17H18O4 — CID 130377348

IUPAC5-(4-ethenylphenoxy)-1,2,3-trimethoxybenzene
SMILESC=Cc1ccc(Oc2cc(OC)c(OC)c(OC)c2)cc1
InChIInChI=1S/C17H18O4/c1-5-12-6-8-13(9-7-12)21-14-10-15(18-2)17(20-4)16(11-14)19-3/h5-11H,1H2,2-4H3
InChIKeyXJYOFFBXOGHDGA-UHFFFAOYSA-N
MW286.33 g/mol
LogP4.15
Rot. Bonds6

About 5-(4-ethenylphenoxy)-1,2,3-trimethoxybenzene

5-(4-ethenylphenoxy)-1,2,3-trimethoxybenzene (PubChem CID 130377348) has the molecular formula C17H18O4 and a molecular weight of 286.33 g/mol. Its IUPAC name is 5-(4-ethenylphenoxy)-1,2,3-trimethoxybenzene.

Molecular Properties

Compound Name5-(4-ethenylphenoxy)-1,2,3-trimethoxybenzene
PubChem CID130377348
Molecular FormulaC17H18O4
Molecular Weight286.33 g/mol
Exact Mass286.12
IUPAC Name5-(4-ethenylphenoxy)-1,2,3-trimethoxybenzene
SMILESC=Cc1ccc(Oc2cc(OC)c(OC)c(OC)c2)cc1
InChIInChI=1S/C17H18O4/c1-5-12-6-8-13(9-7-12)21-14-10-15(18-2)17(20-4)16(11-14)19-3/h5-11H,1H2,2-4H3
InChIKeyXJYOFFBXOGHDGA-UHFFFAOYSA-N
XLogP4.15
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-[(E)-2-(4-ethenylphenyl)ethenyl]-1,2,3-trimethoxybenzene
CID 59348795
1-(4-ethenylphenoxy)-3,5-dimethylbenzene
CID 141340670
4-(3,4,5-trimethoxyphenoxy)benzene-1,2-diamine
CID 106748558
5-ethenyl-2-[2-[2-(4-ethenylphenoxy)ethoxy]ethoxy]-1,3-dimethoxybenzene
CID 11291660
ethane;2-methoxy-5-[4-[2-[4-(4-methoxy-3,5-dimethylphenoxy)phenyl]propan-2-yl]phenoxy]-1,3-dimethylbenzene;styrene
CID 157277221
4-ethenyl-1,2-dimethoxybenzene
CID 159733418
5-ethenyl-2,3-dimethoxyaniline
CID 14166975
N-(4-phenoxyphenyl)-1-(3,4,5-trimethoxyphenyl)methanimine
CID 4505600
4-ethenyl-2-methoxy-1-(4-prop-1-en-2-ylphenoxy)benzene
CID 134533362
1-N,4-N-bis[4-(4-ethenylphenoxy)phenyl]benzene-1,4-diamine
CID 139419448
1,2,3,5-tetramethoxybenzene;1,2,4-trimethoxybenzene
CID 54271001
1-ethenyl-4-methylperoxybenzene
CID 21053359

Frequently Asked Questions

What is the IUPAC name of 5-(4-ethenylphenoxy)-1,2,3-trimethoxybenzene?
The IUPAC name of 5-(4-ethenylphenoxy)-1,2,3-trimethoxybenzene (CID 130377348) is 5-(4-ethenylphenoxy)-1,2,3-trimethoxybenzene.
What is the SMILES notation for 5-(4-ethenylphenoxy)-1,2,3-trimethoxybenzene?
The canonical SMILES for 5-(4-ethenylphenoxy)-1,2,3-trimethoxybenzene is C=Cc1ccc(Oc2cc(OC)c(OC)c(OC)c2)cc1.
What is the InChIKey of 5-(4-ethenylphenoxy)-1,2,3-trimethoxybenzene?
The InChIKey is XJYOFFBXOGHDGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18O4/c1-5-12-6-8-13(9-7-12)21-14-10-15(18-2)17(20-4)16(11-14)19-3/h5-11H,1H2,2-4H3.
What are the key properties of 5-(4-ethenylphenoxy)-1,2,3-trimethoxybenzene?
5-(4-ethenylphenoxy)-1,2,3-trimethoxybenzene has a molecular weight of 286.33 g/mol, XLogP of 4.15, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-ethenylphenoxy)-1,2,3-trimethoxybenzene is sourced from PubChem (CID 130377348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).