1-(methoxymethoxy)-4-[2-(methoxymethoxy)-2-methylpropyl]benzene

C14H22O4 — CID 86007053

IUPAC1-(methoxymethoxy)-4-[2-(methoxymethoxy)-2-methylpropyl]benzene
SMILESCOCOc1ccc(CC(C)(C)OCOC)cc1
InChIInChI=1S/C14H22O4/c1-14(2,18-11-16-4)9-12-5-7-13(8-6-12)17-10-15-3/h5-8H,9-11H2,1-4H3
InChIKeySZQPJSCSQBLDID-UHFFFAOYSA-N
MW254.33 g/mol
LogP2.61
Rot. Bonds8

About 1-(methoxymethoxy)-4-[2-(methoxymethoxy)-2-methylpropyl]benzene

1-(methoxymethoxy)-4-[2-(methoxymethoxy)-2-methylpropyl]benzene (PubChem CID 86007053) has the molecular formula C14H22O4 and a molecular weight of 254.33 g/mol. Its IUPAC name is 1-(methoxymethoxy)-4-[2-(methoxymethoxy)-2-methylpropyl]benzene.

Molecular Properties

Compound Name1-(methoxymethoxy)-4-[2-(methoxymethoxy)-2-methylpropyl]benzene
PubChem CID86007053
Molecular FormulaC14H22O4
Molecular Weight254.33 g/mol
Exact Mass254.15
IUPAC Name1-(methoxymethoxy)-4-[2-(methoxymethoxy)-2-methylpropyl]benzene
SMILESCOCOc1ccc(CC(C)(C)OCOC)cc1
InChIInChI=1S/C14H22O4/c1-14(2,18-11-16-4)9-12-5-7-13(8-6-12)17-10-15-3/h5-8H,9-11H2,1-4H3
InChIKeySZQPJSCSQBLDID-UHFFFAOYSA-N
XLogP2.61
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1,4-bis(methoxymethoxy)benzene
CID 542643
1-ethyl-4-(methoxymethoxy)benzene
CID 54365082
1-(methoxymethoxy)-4-(methoxymethyl)benzene
CID 59017141
[4-(methoxymethoxy)phenyl]methanol
CID 11607984
2-[4-(methoxymethoxy)phenyl]ethanol
CID 16638841
2-amino-2-[[4-(methoxymethoxy)phenyl]methyl]butanoic acid
CID 146628259
1-(methoxymethoxy)-4-[1-[2-[4-(methoxymethoxy)phenyl]-2-methylpropoxy]-2-methylpropan-2-yl]benzene
CID 57168738
2-amino-2-(fluoromethyl)-3-[4-(methoxymethoxy)phenyl]propanoic acid
CID 175606160
1-(methoxymethoxy)-4-(trifluoromethyl)benzene
CID 11009076
1-methoxy-4-[4-(methoxymethoxy)phenyl]benzene
CID 58029226
1-(methoxymethoxy)-4-[2-[4-(methoxymethoxy)phenyl]ethenyl]benzene
CID 5098450
sodium tetrakis[4-(methoxymethoxy)phenyl]boranuide
CID 177046076

Frequently Asked Questions

What is the IUPAC name of 1-(methoxymethoxy)-4-[2-(methoxymethoxy)-2-methylpropyl]benzene?
The IUPAC name of 1-(methoxymethoxy)-4-[2-(methoxymethoxy)-2-methylpropyl]benzene (CID 86007053) is 1-(methoxymethoxy)-4-[2-(methoxymethoxy)-2-methylpropyl]benzene.
What is the SMILES notation for 1-(methoxymethoxy)-4-[2-(methoxymethoxy)-2-methylpropyl]benzene?
The canonical SMILES for 1-(methoxymethoxy)-4-[2-(methoxymethoxy)-2-methylpropyl]benzene is COCOc1ccc(CC(C)(C)OCOC)cc1.
What is the InChIKey of 1-(methoxymethoxy)-4-[2-(methoxymethoxy)-2-methylpropyl]benzene?
The InChIKey is SZQPJSCSQBLDID-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22O4/c1-14(2,18-11-16-4)9-12-5-7-13(8-6-12)17-10-15-3/h5-8H,9-11H2,1-4H3.
What are the key properties of 1-(methoxymethoxy)-4-[2-(methoxymethoxy)-2-methylpropyl]benzene?
1-(methoxymethoxy)-4-[2-(methoxymethoxy)-2-methylpropyl]benzene has a molecular weight of 254.33 g/mol, XLogP of 2.61, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methoxymethoxy)-4-[2-(methoxymethoxy)-2-methylpropyl]benzene is sourced from PubChem (CID 86007053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).