1-ethyl-2-methoxy-4-methylbenzene

C10H14O — CID 12732702

IUPAC1-ethyl-2-methoxy-4-methylbenzene
SMILESCCc1ccc(C)cc1OC
InChIInChI=1S/C10H14O/c1-4-9-6-5-8(2)7-10(9)11-3/h5-7H,4H2,1-3H3
InChIKeyYXGLDKRLPDQGHP-UHFFFAOYSA-N
MW150.22 g/mol
LogP2.57
Rot. Bonds2

About 1-ethyl-2-methoxy-4-methylbenzene

1-ethyl-2-methoxy-4-methylbenzene (PubChem CID 12732702) has the molecular formula C10H14O and a molecular weight of 150.22 g/mol. Its IUPAC name is 1-ethyl-2-methoxy-4-methylbenzene.

Molecular Properties

Compound Name1-ethyl-2-methoxy-4-methylbenzene
PubChem CID12732702
Molecular FormulaC10H14O
Molecular Weight150.22 g/mol
Exact Mass150.10
IUPAC Name1-ethyl-2-methoxy-4-methylbenzene
SMILESCCc1ccc(C)cc1OC
InChIInChI=1S/C10H14O/c1-4-9-6-5-8(2)7-10(9)11-3/h5-7H,4H2,1-3H3
InChIKeyYXGLDKRLPDQGHP-UHFFFAOYSA-N
XLogP2.57
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2-methoxy-4-methylbenzene?
The IUPAC name of 1-ethyl-2-methoxy-4-methylbenzene (CID 12732702) is 1-ethyl-2-methoxy-4-methylbenzene.
What is the SMILES notation for 1-ethyl-2-methoxy-4-methylbenzene?
The canonical SMILES for 1-ethyl-2-methoxy-4-methylbenzene is CCc1ccc(C)cc1OC.
What is the InChIKey of 1-ethyl-2-methoxy-4-methylbenzene?
The InChIKey is YXGLDKRLPDQGHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O/c1-4-9-6-5-8(2)7-10(9)11-3/h5-7H,4H2,1-3H3.
What are the key properties of 1-ethyl-2-methoxy-4-methylbenzene?
1-ethyl-2-methoxy-4-methylbenzene has a molecular weight of 150.22 g/mol, XLogP of 2.57, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2-methoxy-4-methylbenzene is sourced from PubChem (CID 12732702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).