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

C12H18O2 — CID 11805608

IUPAC[2-(methoxymethoxy)-2-methylpropyl]benzene
SMILESCOCOC(C)(C)Cc1ccccc1
InChIInChI=1S/C12H18O2/c1-12(2,14-10-13-3)9-11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3
InChIKeyUOKNJMZTTVSNLK-UHFFFAOYSA-N
MW194.27 g/mol
LogP2.63
Rot. Bonds5

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

[2-(methoxymethoxy)-2-methylpropyl]benzene (PubChem CID 11805608) has the molecular formula C12H18O2 and a molecular weight of 194.27 g/mol. Its IUPAC name is [2-(methoxymethoxy)-2-methylpropyl]benzene.

Molecular Properties

Compound Name[2-(methoxymethoxy)-2-methylpropyl]benzene
PubChem CID11805608
Molecular FormulaC12H18O2
Molecular Weight194.27 g/mol
Exact Mass194.13
IUPAC Name[2-(methoxymethoxy)-2-methylpropyl]benzene
SMILESCOCOC(C)(C)Cc1ccccc1
InChIInChI=1S/C12H18O2/c1-12(2,14-10-13-3)9-11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3
InChIKeyUOKNJMZTTVSNLK-UHFFFAOYSA-N
XLogP2.63
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.27
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [2-(methoxymethoxy)-2-methylpropyl]benzene?
The IUPAC name of [2-(methoxymethoxy)-2-methylpropyl]benzene (CID 11805608) is [2-(methoxymethoxy)-2-methylpropyl]benzene.
What is the SMILES notation for [2-(methoxymethoxy)-2-methylpropyl]benzene?
The canonical SMILES for [2-(methoxymethoxy)-2-methylpropyl]benzene is COCOC(C)(C)Cc1ccccc1.
What is the InChIKey of [2-(methoxymethoxy)-2-methylpropyl]benzene?
The InChIKey is UOKNJMZTTVSNLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18O2/c1-12(2,14-10-13-3)9-11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3.
What are the key properties of [2-(methoxymethoxy)-2-methylpropyl]benzene?
[2-(methoxymethoxy)-2-methylpropyl]benzene has a molecular weight of 194.27 g/mol, XLogP of 2.63, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(methoxymethoxy)-2-methylpropyl]benzene is sourced from PubChem (CID 11805608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).