1-(methoxymethoxy)-4-(methoxymethyl)benzene

C10H14O3 — CID 59017141

IUPAC1-(methoxymethoxy)-4-(methoxymethyl)benzene
SMILESCOCOc1ccc(COC)cc1
InChIInChI=1S/C10H14O3/c1-11-7-9-3-5-10(6-4-9)13-8-12-2/h3-6H,7-8H2,1-2H3
InChIKeyNCGIRMCLRVOCPU-UHFFFAOYSA-N
MW182.22 g/mol
LogP1.82
Rot. Bonds5

About 1-(methoxymethoxy)-4-(methoxymethyl)benzene

1-(methoxymethoxy)-4-(methoxymethyl)benzene (PubChem CID 59017141) has the molecular formula C10H14O3 and a molecular weight of 182.22 g/mol. Its IUPAC name is 1-(methoxymethoxy)-4-(methoxymethyl)benzene.

Molecular Properties

Compound Name1-(methoxymethoxy)-4-(methoxymethyl)benzene
PubChem CID59017141
Molecular FormulaC10H14O3
Molecular Weight182.22 g/mol
Exact Mass182.09
IUPAC Name1-(methoxymethoxy)-4-(methoxymethyl)benzene
SMILESCOCOc1ccc(COC)cc1
InChIInChI=1S/C10H14O3/c1-11-7-9-3-5-10(6-4-9)13-8-12-2/h3-6H,7-8H2,1-2H3
InChIKeyNCGIRMCLRVOCPU-UHFFFAOYSA-N
XLogP1.82
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.22
LogP ≤ 51.82
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
1-ethyl-4-(methoxymethoxy)benzene
CID 54365082
[4-(methoxymethoxy)phenyl]methanol
CID 11607984
2-[4-(methoxymethoxy)phenyl]ethanol
CID 16638841
1-(methoxymethoxy)-3-(methoxymethyl)benzene
CID 138736318
1-(methoxymethoxy)-4-[2-(methoxymethoxy)-2-methylpropyl]benzene
CID 86007053
1-(methoxymethoxy)-4-[4-[4-(pentoxymethyl)phenyl]phenyl]benzene
CID 139620360
1-methoxy-4-[4-(methoxymethoxy)phenyl]benzene
CID 58029226
tris[4-(methoxymethyl)phenyl] borate
CID 70231654
1-(methoxymethoxy)-4-[2-[4-(methoxymethoxy)phenyl]ethenyl]benzene
CID 5098450
sodium tetrakis[4-(methoxymethoxy)phenyl]boranuide
CID 177046076
1-(methoxymethyl)-4-[[4-(methoxymethyl)phenyl]methoxymethyl]benzene
CID 21396720

Frequently Asked Questions

What is the IUPAC name of 1-(methoxymethoxy)-4-(methoxymethyl)benzene?
The IUPAC name of 1-(methoxymethoxy)-4-(methoxymethyl)benzene (CID 59017141) is 1-(methoxymethoxy)-4-(methoxymethyl)benzene.
What is the SMILES notation for 1-(methoxymethoxy)-4-(methoxymethyl)benzene?
The canonical SMILES for 1-(methoxymethoxy)-4-(methoxymethyl)benzene is COCOc1ccc(COC)cc1.
What is the InChIKey of 1-(methoxymethoxy)-4-(methoxymethyl)benzene?
The InChIKey is NCGIRMCLRVOCPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O3/c1-11-7-9-3-5-10(6-4-9)13-8-12-2/h3-6H,7-8H2,1-2H3.
What are the key properties of 1-(methoxymethoxy)-4-(methoxymethyl)benzene?
1-(methoxymethoxy)-4-(methoxymethyl)benzene has a molecular weight of 182.22 g/mol, XLogP of 1.82, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methoxymethoxy)-4-(methoxymethyl)benzene is sourced from PubChem (CID 59017141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).