2,4-dimethoxy-1-methyl-2,3-dihydronaphthalene

C13H16O2 — CID 18740202

IUPAC2,4-dimethoxy-1-methyl-2,3-dihydronaphthalene
SMILESCOC1=c2ccccc2=C(C)C(OC)C1
InChIInChI=1S/C13H16O2/c1-9-10-6-4-5-7-11(10)13(15-3)8-12(9)14-2/h4-7,12H,8H2,1-3H3
InChIKeyCHROQSVMXYVNMJ-UHFFFAOYSA-N
MW204.27 g/mol
LogP1.03
Rot. Bonds2

About 2,4-dimethoxy-1-methyl-2,3-dihydronaphthalene

2,4-dimethoxy-1-methyl-2,3-dihydronaphthalene (PubChem CID 18740202) has the molecular formula C13H16O2 and a molecular weight of 204.27 g/mol. Its IUPAC name is 2,4-dimethoxy-1-methyl-2,3-dihydronaphthalene.

Molecular Properties

Compound Name2,4-dimethoxy-1-methyl-2,3-dihydronaphthalene
PubChem CID18740202
Molecular FormulaC13H16O2
Molecular Weight204.27 g/mol
Exact Mass204.12
IUPAC Name2,4-dimethoxy-1-methyl-2,3-dihydronaphthalene
SMILESCOC1=c2ccccc2=C(C)C(OC)C1
InChIInChI=1S/C13H16O2/c1-9-10-6-4-5-7-11(10)13(15-3)8-12(9)14-2/h4-7,12H,8H2,1-3H3
InChIKeyCHROQSVMXYVNMJ-UHFFFAOYSA-N
XLogP1.03
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 51.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethoxy-1-methyl-2,3-dihydronaphthalene?
The IUPAC name of 2,4-dimethoxy-1-methyl-2,3-dihydronaphthalene (CID 18740202) is 2,4-dimethoxy-1-methyl-2,3-dihydronaphthalene.
What is the SMILES notation for 2,4-dimethoxy-1-methyl-2,3-dihydronaphthalene?
The canonical SMILES for 2,4-dimethoxy-1-methyl-2,3-dihydronaphthalene is COC1=c2ccccc2=C(C)C(OC)C1.
What is the InChIKey of 2,4-dimethoxy-1-methyl-2,3-dihydronaphthalene?
The InChIKey is CHROQSVMXYVNMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16O2/c1-9-10-6-4-5-7-11(10)13(15-3)8-12(9)14-2/h4-7,12H,8H2,1-3H3.
What are the key properties of 2,4-dimethoxy-1-methyl-2,3-dihydronaphthalene?
2,4-dimethoxy-1-methyl-2,3-dihydronaphthalene has a molecular weight of 204.27 g/mol, XLogP of 1.03, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethoxy-1-methyl-2,3-dihydronaphthalene is sourced from PubChem (CID 18740202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).