2-[2-[2-[2-[(2,5-dimethoxyphenyl)methoxy]ethoxy]ethoxy]ethoxymethyl]-1,4-dimethoxybenzene

C24H34O8 — CID 15109386

IUPAC2-[2-[2-[2-[(2,5-dimethoxyphenyl)methoxy]ethoxy]ethoxy]ethoxymethyl]-1,4-dimethoxybenzene
SMILESCOc1ccc(OC)c(COCCOCCOCCOCc2cc(OC)ccc2OC)c1
InChIInChI=1S/C24H34O8/c1-25-21-5-7-23(27-3)19(15-21)17-31-13-11-29-9-10-30-12-14-32-18-20-16-22(26-2)6-8-24(20)28-4/h5-8,15-16H,9-14,17-18H2,1-4H3
InChIKeyWTTMWYQPYNQOKN-UHFFFAOYSA-N
MW450.53 g/mol
LogP3.49
Rot. Bonds17

About 2-[2-[2-[2-[(2,5-dimethoxyphenyl)methoxy]ethoxy]ethoxy]ethoxymethyl]-1,4-dimethoxybenzene

2-[2-[2-[2-[(2,5-dimethoxyphenyl)methoxy]ethoxy]ethoxy]ethoxymethyl]-1,4-dimethoxybenzene (PubChem CID 15109386) has the molecular formula C24H34O8 and a molecular weight of 450.53 g/mol. Its IUPAC name is 2-[2-[2-[2-[(2,5-dimethoxyphenyl)methoxy]ethoxy]ethoxy]ethoxymethyl]-1,4-dimethoxybenzene.

Molecular Properties

Compound Name2-[2-[2-[2-[(2,5-dimethoxyphenyl)methoxy]ethoxy]ethoxy]ethoxymethyl]-1,4-dimethoxybenzene
PubChem CID15109386
Molecular FormulaC24H34O8
Molecular Weight450.53 g/mol
Exact Mass450.23
IUPAC Name2-[2-[2-[2-[(2,5-dimethoxyphenyl)methoxy]ethoxy]ethoxy]ethoxymethyl]-1,4-dimethoxybenzene
SMILESCOc1ccc(OC)c(COCCOCCOCCOCc2cc(OC)ccc2OC)c1
InChIInChI=1S/C24H34O8/c1-25-21-5-7-23(27-3)19(15-21)17-31-13-11-29-9-10-30-12-14-32-18-20-16-22(26-2)6-8-24(20)28-4/h5-8,15-16H,9-14,17-18H2,1-4H3
InChIKeyWTTMWYQPYNQOKN-UHFFFAOYSA-N
XLogP3.49
TPSA73.84 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds17
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500450.53
LogP ≤ 53.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Related Compounds

2-(ethoxymethyl)-1,4-dimethoxybenzene
CID 12068886
(2,5-dimethoxyphenyl)methyl methanesulfonate;ethane
CID 90981417
N-[[3-(2-butoxyethoxymethyl)-4-methoxyphenyl]methyl]ethanamine
CID 62017074
1,4-dimethoxy-2-(nitrosomethyl)benzene
CID 143996904
N,N,1,1,2,2-hexadeuterio-2-(2,5-dimethoxyphenyl)ethanamine
CID 71777141
2-(2-bromo-2-methylpropyl)-1,4-dimethoxybenzene
CID 82255120
(2,5-dimethoxyphenyl)methyl 2,2-dimethylpropanoate
CID 10933987
4-methoxy-3-[2-(3-methoxypropoxy)ethoxymethyl]benzonitrile
CID 103177614
2,4-dimethoxy-1-(non-8-enoxymethyl)benzene
CID 155664425
2-[(5-bromo-2-methoxyphenyl)methoxy]ethanol
CID 162503231
(2S)-1-(azepan-1-yl)-3-[(2,5-dimethoxyphenyl)methoxy]propan-2-ol
CID 42588345
2-(3-fluoropropyl)-1,4-dimethoxybenzene
CID 83938230

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-[2-[(2,5-dimethoxyphenyl)methoxy]ethoxy]ethoxy]ethoxymethyl]-1,4-dimethoxybenzene?
The IUPAC name of 2-[2-[2-[2-[(2,5-dimethoxyphenyl)methoxy]ethoxy]ethoxy]ethoxymethyl]-1,4-dimethoxybenzene (CID 15109386) is 2-[2-[2-[2-[(2,5-dimethoxyphenyl)methoxy]ethoxy]ethoxy]ethoxymethyl]-1,4-dimethoxybenzene.
What is the SMILES notation for 2-[2-[2-[2-[(2,5-dimethoxyphenyl)methoxy]ethoxy]ethoxy]ethoxymethyl]-1,4-dimethoxybenzene?
The canonical SMILES for 2-[2-[2-[2-[(2,5-dimethoxyphenyl)methoxy]ethoxy]ethoxy]ethoxymethyl]-1,4-dimethoxybenzene is COc1ccc(OC)c(COCCOCCOCCOCc2cc(OC)ccc2OC)c1.
What is the InChIKey of 2-[2-[2-[2-[(2,5-dimethoxyphenyl)methoxy]ethoxy]ethoxy]ethoxymethyl]-1,4-dimethoxybenzene?
The InChIKey is WTTMWYQPYNQOKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H34O8/c1-25-21-5-7-23(27-3)19(15-21)17-31-13-11-29-9-10-30-12-14-32-18-20-16-22(26-2)6-8-24(20)28-4/h5-8,15-16H,9-14,17-18H2,1-4H3.
What are the key properties of 2-[2-[2-[2-[(2,5-dimethoxyphenyl)methoxy]ethoxy]ethoxy]ethoxymethyl]-1,4-dimethoxybenzene?
2-[2-[2-[2-[(2,5-dimethoxyphenyl)methoxy]ethoxy]ethoxy]ethoxymethyl]-1,4-dimethoxybenzene has a molecular weight of 450.53 g/mol, XLogP of 3.49, 17 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-[2-[(2,5-dimethoxyphenyl)methoxy]ethoxy]ethoxy]ethoxymethyl]-1,4-dimethoxybenzene is sourced from PubChem (CID 15109386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).