1,4-dimethoxy-2,3,5-trimethylbenzene

C11H16O2 — CID 10924069

IUPAC1,4-dimethoxy-2,3,5-trimethylbenzene
SMILESCOc1cc(C)c(OC)c(C)c1C
InChIInChI=1S/C11H16O2/c1-7-6-10(12-4)8(2)9(3)11(7)13-5/h6H,1-5H3
InChIKeyGZZYDSKWJOBDHZ-UHFFFAOYSA-N
MW180.25 g/mol
LogP2.63
Rot. Bonds2

About 1,4-dimethoxy-2,3,5-trimethylbenzene

1,4-dimethoxy-2,3,5-trimethylbenzene (PubChem CID 10924069) has the molecular formula C11H16O2 and a molecular weight of 180.25 g/mol. Its IUPAC name is 1,4-dimethoxy-2,3,5-trimethylbenzene.

Molecular Properties

Compound Name1,4-dimethoxy-2,3,5-trimethylbenzene
PubChem CID10924069
Molecular FormulaC11H16O2
Molecular Weight180.25 g/mol
Exact Mass180.12
IUPAC Name1,4-dimethoxy-2,3,5-trimethylbenzene
SMILESCOc1cc(C)c(OC)c(C)c1C
InChIInChI=1S/C11H16O2/c1-7-6-10(12-4)8(2)9(3)11(7)13-5/h6H,1-5H3
InChIKeyGZZYDSKWJOBDHZ-UHFFFAOYSA-N
XLogP2.63
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,4-dimethoxy-2,3,5-trimethylbenzene?
The IUPAC name of 1,4-dimethoxy-2,3,5-trimethylbenzene (CID 10924069) is 1,4-dimethoxy-2,3,5-trimethylbenzene.
What is the SMILES notation for 1,4-dimethoxy-2,3,5-trimethylbenzene?
The canonical SMILES for 1,4-dimethoxy-2,3,5-trimethylbenzene is COc1cc(C)c(OC)c(C)c1C.
What is the InChIKey of 1,4-dimethoxy-2,3,5-trimethylbenzene?
The InChIKey is GZZYDSKWJOBDHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16O2/c1-7-6-10(12-4)8(2)9(3)11(7)13-5/h6H,1-5H3.
What are the key properties of 1,4-dimethoxy-2,3,5-trimethylbenzene?
1,4-dimethoxy-2,3,5-trimethylbenzene has a molecular weight of 180.25 g/mol, XLogP of 2.63, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dimethoxy-2,3,5-trimethylbenzene is sourced from PubChem (CID 10924069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).