1-methoxy-4-[4-(methoxymethoxy)phenyl]benzene

C15H16O3 — CID 58029226

IUPAC1-methoxy-4-[4-(methoxymethoxy)phenyl]benzene
SMILESCOCOc1ccc(-c2ccc(OC)cc2)cc1
InChIInChI=1S/C15H16O3/c1-16-11-18-15-9-5-13(6-10-15)12-3-7-14(17-2)8-4-12/h3-10H,11H2,1-2H3
InChIKeyAVJHNMHDGZTXQQ-UHFFFAOYSA-N
MW244.29 g/mol
LogP3.34
Rot. Bonds5

About 1-methoxy-4-[4-(methoxymethoxy)phenyl]benzene

1-methoxy-4-[4-(methoxymethoxy)phenyl]benzene (PubChem CID 58029226) has the molecular formula C15H16O3 and a molecular weight of 244.29 g/mol. Its IUPAC name is 1-methoxy-4-[4-(methoxymethoxy)phenyl]benzene.

Molecular Properties

Compound Name1-methoxy-4-[4-(methoxymethoxy)phenyl]benzene
PubChem CID58029226
Molecular FormulaC15H16O3
Molecular Weight244.29 g/mol
Exact Mass244.11
IUPAC Name1-methoxy-4-[4-(methoxymethoxy)phenyl]benzene
SMILESCOCOc1ccc(-c2ccc(OC)cc2)cc1
InChIInChI=1S/C15H16O3/c1-16-11-18-15-9-5-13(6-10-15)12-3-7-14(17-2)8-4-12/h3-10H,11H2,1-2H3
InChIKeyAVJHNMHDGZTXQQ-UHFFFAOYSA-N
XLogP3.34
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 53.34
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

1,4-bis(methoxymethoxy)benzene
CID 542643
4-[4,6-bis[4-(methoxymethoxy)phenyl]-1,3,5-triazin-2-yl]phenol
CID 137270193
2-[4-(methoxymethoxy)phenyl]-3-(4-methoxyphenyl)butanedinitrile
CID 67215235
1-methoxy-4-[1-[4-(methoxymethoxy)phenyl]cyclopentyl]benzene
CID 140897916
1,3-dimethoxy-5-(methoxymethoxy)benzene
CID 11194953
1-ethyl-4-(methoxymethoxy)benzene
CID 54365082
sodium tetrakis[4-(methoxymethoxy)phenyl]boranuide
CID 177046076
1-(methoxymethoxy)-4-(methoxymethyl)benzene
CID 59017141
1-(methoxymethoxy)-4-[2-[4-(methoxymethoxy)phenyl]ethenyl]benzene
CID 5098450
[4-[4-(methoxymethoxy)phenyl]phenoxy]methyl prop-2-enoate
CID 59281810
[4-(methoxymethoxy)phenyl]-methylsilane
CID 162133771
[4-(methoxymethoxy)phenyl]methanol
CID 11607984

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-4-[4-(methoxymethoxy)phenyl]benzene?
The IUPAC name of 1-methoxy-4-[4-(methoxymethoxy)phenyl]benzene (CID 58029226) is 1-methoxy-4-[4-(methoxymethoxy)phenyl]benzene.
What is the SMILES notation for 1-methoxy-4-[4-(methoxymethoxy)phenyl]benzene?
The canonical SMILES for 1-methoxy-4-[4-(methoxymethoxy)phenyl]benzene is COCOc1ccc(-c2ccc(OC)cc2)cc1.
What is the InChIKey of 1-methoxy-4-[4-(methoxymethoxy)phenyl]benzene?
The InChIKey is AVJHNMHDGZTXQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O3/c1-16-11-18-15-9-5-13(6-10-15)12-3-7-14(17-2)8-4-12/h3-10H,11H2,1-2H3.
What are the key properties of 1-methoxy-4-[4-(methoxymethoxy)phenyl]benzene?
1-methoxy-4-[4-(methoxymethoxy)phenyl]benzene has a molecular weight of 244.29 g/mol, XLogP of 3.34, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-4-[4-(methoxymethoxy)phenyl]benzene is sourced from PubChem (CID 58029226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).