1-methoxy-2-[2-(4-methoxyphenoxy)ethoxy]benzene

C16H18O4 — CID 78767785

IUPAC1-methoxy-2-[2-(4-methoxyphenoxy)ethoxy]benzene
SMILESCOc1ccc(OCCOc2ccccc2OC)cc1
InChIInChI=1S/C16H18O4/c1-17-13-7-9-14(10-8-13)19-11-12-20-16-6-4-3-5-15(16)18-2/h3-10H,11-12H2,1-2H3
InChIKeyGPBBMFZLLBFUDF-UHFFFAOYSA-N
MW274.32 g/mol
LogP3.16
Rot. Bonds7

About 1-methoxy-2-[2-(4-methoxyphenoxy)ethoxy]benzene

1-methoxy-2-[2-(4-methoxyphenoxy)ethoxy]benzene (PubChem CID 78767785) has the molecular formula C16H18O4 and a molecular weight of 274.32 g/mol. Its IUPAC name is 1-methoxy-2-[2-(4-methoxyphenoxy)ethoxy]benzene.

Molecular Properties

Compound Name1-methoxy-2-[2-(4-methoxyphenoxy)ethoxy]benzene
PubChem CID78767785
Molecular FormulaC16H18O4
Molecular Weight274.32 g/mol
Exact Mass274.12
IUPAC Name1-methoxy-2-[2-(4-methoxyphenoxy)ethoxy]benzene
SMILESCOc1ccc(OCCOc2ccccc2OC)cc1
InChIInChI=1S/C16H18O4/c1-17-13-7-9-14(10-8-13)19-11-12-20-16-6-4-3-5-15(16)18-2/h3-10H,11-12H2,1-2H3
InChIKeyGPBBMFZLLBFUDF-UHFFFAOYSA-N
XLogP3.16
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-methoxy-2-(4-phenoxybutoxy)benzene
CID 2252132
[2-[2-(4-methoxyphenoxy)ethoxy]phenyl]methanol
CID 60773075
1-methoxy-2-[12-(2-methoxyphenoxy)dodecoxy]benzene
CID 134880850
4-[2-(2-methoxyphenoxy)ethoxy]benzenecarboximidamide
CID 61300207
4-[3-(2-methoxyphenoxy)propoxy]-1,2-dimethylbenzene
CID 2251577
1-(2-ethoxyethoxy)-2-methoxybenzene
CID 57249631
methyl 4-[4-(2-methoxyphenoxy)butoxy]benzoate
CID 16614189
2-chloro-5-[2-(2-methoxyphenoxy)ethoxy]-1,3-dimethylbenzene
CID 2284147
3-[2-(2-methoxyphenoxy)ethoxy]phenol
CID 39360613
2-bromo-3-[2-(4-methoxyphenoxy)ethoxy]pyridine
CID 62047657
2-amino-3-[2-(4-methoxyphenoxy)ethoxy]phenol
CID 114764222
2-[4-[2-(2-methoxyphenoxy)ethoxy]phenyl]-4-methyl-1,3-thiazole-5-carboxylic acid
CID 20988096

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-2-[2-(4-methoxyphenoxy)ethoxy]benzene?
The IUPAC name of 1-methoxy-2-[2-(4-methoxyphenoxy)ethoxy]benzene (CID 78767785) is 1-methoxy-2-[2-(4-methoxyphenoxy)ethoxy]benzene.
What is the SMILES notation for 1-methoxy-2-[2-(4-methoxyphenoxy)ethoxy]benzene?
The canonical SMILES for 1-methoxy-2-[2-(4-methoxyphenoxy)ethoxy]benzene is COc1ccc(OCCOc2ccccc2OC)cc1.
What is the InChIKey of 1-methoxy-2-[2-(4-methoxyphenoxy)ethoxy]benzene?
The InChIKey is GPBBMFZLLBFUDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18O4/c1-17-13-7-9-14(10-8-13)19-11-12-20-16-6-4-3-5-15(16)18-2/h3-10H,11-12H2,1-2H3.
What are the key properties of 1-methoxy-2-[2-(4-methoxyphenoxy)ethoxy]benzene?
1-methoxy-2-[2-(4-methoxyphenoxy)ethoxy]benzene has a molecular weight of 274.32 g/mol, XLogP of 3.16, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-2-[2-(4-methoxyphenoxy)ethoxy]benzene is sourced from PubChem (CID 78767785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).