1-(methoxymethoxy)-2-[(4-phenoxyphenyl)methyl]benzene

C21H20O3 — CID 141142570

IUPAC1-(methoxymethoxy)-2-[(4-phenoxyphenyl)methyl]benzene
SMILESCOCOc1ccccc1Cc1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C21H20O3/c1-22-16-23-21-10-6-5-7-18(21)15-17-11-13-20(14-12-17)24-19-8-3-2-4-9-19/h2-14H,15-16H2,1H3
InChIKeyBMYBEIMFYRKSNK-UHFFFAOYSA-N
MW320.39 g/mol
LogP5.05
Rot. Bonds7

About 1-(methoxymethoxy)-2-[(4-phenoxyphenyl)methyl]benzene

1-(methoxymethoxy)-2-[(4-phenoxyphenyl)methyl]benzene (PubChem CID 141142570) has the molecular formula C21H20O3 and a molecular weight of 320.39 g/mol. Its IUPAC name is 1-(methoxymethoxy)-2-[(4-phenoxyphenyl)methyl]benzene.

Molecular Properties

Compound Name1-(methoxymethoxy)-2-[(4-phenoxyphenyl)methyl]benzene
PubChem CID141142570
Molecular FormulaC21H20O3
Molecular Weight320.39 g/mol
Exact Mass320.14
IUPAC Name1-(methoxymethoxy)-2-[(4-phenoxyphenyl)methyl]benzene
SMILESCOCOc1ccccc1Cc1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C21H20O3/c1-22-16-23-21-10-6-5-7-18(21)15-17-11-13-20(14-12-17)24-19-8-3-2-4-9-19/h2-14H,15-16H2,1H3
InChIKeyBMYBEIMFYRKSNK-UHFFFAOYSA-N
XLogP5.05
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500320.39
LogP ≤ 55.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

4-(methoxymethoxy)-3-[(4-phenoxyphenyl)methyl]benzaldehyde
CID 86235408
diethoxyphosphoryl-[4-(methoxymethoxy)-3-[(4-phenoxyphenyl)methyl]phenyl]methanol
CID 91115614
1-benzyl-2-phenoxybenzene;phosphane
CID 174871749
ethane;1-phenoxy-4-[(4-phenoxyphenyl)methyl]benzene
CID 143793194
1,2,3-trimethoxy-4-[(4-phenoxyphenyl)methyl]benzene
CID 54421334
[2-(methoxymethoxy)phenyl]methanol
CID 10920904
2-(2-benzylphenoxy)-N-methylethanamine
CID 12660328
1-(cyclohexen-1-ylmethyl)-2-(methoxymethoxy)benzene
CID 14446892
1-methoxy-2-[(4-phenylphenyl)methyl]benzene
CID 174370208
2-methylpropane;phenoxybenzene;1-propan-2-yl-4-(4-propan-2-ylphenoxy)benzene;1-propan-2-yl-2-[(4-propan-2-ylphenyl)methyl]benzene
CID 167608354
2-benzyl-6-(methoxymethoxy)naphthalene
CID 132602813
[2-(methoxymethoxy)phenyl]methyl-triphenylphosphanium chloride
CID 19423996

Frequently Asked Questions

What is the IUPAC name of 1-(methoxymethoxy)-2-[(4-phenoxyphenyl)methyl]benzene?
The IUPAC name of 1-(methoxymethoxy)-2-[(4-phenoxyphenyl)methyl]benzene (CID 141142570) is 1-(methoxymethoxy)-2-[(4-phenoxyphenyl)methyl]benzene.
What is the SMILES notation for 1-(methoxymethoxy)-2-[(4-phenoxyphenyl)methyl]benzene?
The canonical SMILES for 1-(methoxymethoxy)-2-[(4-phenoxyphenyl)methyl]benzene is COCOc1ccccc1Cc1ccc(Oc2ccccc2)cc1.
What is the InChIKey of 1-(methoxymethoxy)-2-[(4-phenoxyphenyl)methyl]benzene?
The InChIKey is BMYBEIMFYRKSNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20O3/c1-22-16-23-21-10-6-5-7-18(21)15-17-11-13-20(14-12-17)24-19-8-3-2-4-9-19/h2-14H,15-16H2,1H3.
What are the key properties of 1-(methoxymethoxy)-2-[(4-phenoxyphenyl)methyl]benzene?
1-(methoxymethoxy)-2-[(4-phenoxyphenyl)methyl]benzene has a molecular weight of 320.39 g/mol, XLogP of 5.05, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methoxymethoxy)-2-[(4-phenoxyphenyl)methyl]benzene is sourced from PubChem (CID 141142570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).