5,6-dimethoxy-1,1,2-trimethylindene

C14H18O2 — CID 23377407

IUPAC5,6-dimethoxy-1,1,2-trimethylindene
SMILESCOc1cc2c(cc1OC)C(C)(C)C(C)=C2
InChIInChI=1S/C14H18O2/c1-9-6-10-7-12(15-4)13(16-5)8-11(10)14(9,2)3/h6-8H,1-5H3
InChIKeyASEWUMJXOFFUJM-UHFFFAOYSA-N
MW218.30 g/mol
LogP3.40
Rot. Bonds2

About 5,6-dimethoxy-1,1,2-trimethylindene

5,6-dimethoxy-1,1,2-trimethylindene (PubChem CID 23377407) has the molecular formula C14H18O2 and a molecular weight of 218.30 g/mol. Its IUPAC name is 5,6-dimethoxy-1,1,2-trimethylindene.

Molecular Properties

Compound Name5,6-dimethoxy-1,1,2-trimethylindene
PubChem CID23377407
Molecular FormulaC14H18O2
Molecular Weight218.30 g/mol
Exact Mass218.13
IUPAC Name5,6-dimethoxy-1,1,2-trimethylindene
SMILESCOc1cc2c(cc1OC)C(C)(C)C(C)=C2
InChIInChI=1S/C14H18O2/c1-9-6-10-7-12(15-4)13(16-5)8-11(10)14(9,2)3/h6-8H,1-5H3
InChIKeyASEWUMJXOFFUJM-UHFFFAOYSA-N
XLogP3.40
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5,6-dimethoxy-2,3,3-trimethylindole
CID 12844901
1,8-diethyl-17,18-dimethoxypentacyclo[6.6.6.02,7.09,14.015,20]icosa-2,6,9,13,15,17,19-heptaene-4,5,11,12-tetrone
CID 122210307
2,3-dimethoxy-9,9-dimethylfluorene
CID 134997139
5,6-dimethoxy-1,3,3-trimethylindol-2-one
CID 82496589
3-(3,4-dimethoxyphenyl)-6,7-dimethoxy-1-methyl-1-thiophen-2-ylisochromene
CID 15358081
5,6-dimethoxy-3,3-dimethyl-2-methylideneinden-1-one
CID 129213364
(E)-3-(5,6-dimethoxy-1,1-dimethylinden-2-yl)-1-[4-[3-[1-[(E)-3-(5,6-dimethoxy-1,1-dimethylinden-2-yl)prop-2-enoyl]piperidin-4-yl]propyl]piperidin-1-yl]prop-2-en-1-one
CID 18770456
6,7-dimethoxy-3-(4-methoxyphenyl)-1-methyl-1-phenylisochromene
CID 132765787
3-(3,4-diethoxyphenyl)-6,7-dimethoxy-1-methyl-1-phenylisochromene
CID 132779363
6,7-dimethoxy-3-methyl-1,2-dihydronaphthalene
CID 10703379
3,6,9-trimethoxy-1,1,7-trimethylphenanthren-2-one
CID 14731300
2-[3-(4-ethoxyphenyl)-6,7-dimethoxy-1-methylisochromen-1-yl]acetic acid
CID 15548266

Frequently Asked Questions

What is the IUPAC name of 5,6-dimethoxy-1,1,2-trimethylindene?
The IUPAC name of 5,6-dimethoxy-1,1,2-trimethylindene (CID 23377407) is 5,6-dimethoxy-1,1,2-trimethylindene.
What is the SMILES notation for 5,6-dimethoxy-1,1,2-trimethylindene?
The canonical SMILES for 5,6-dimethoxy-1,1,2-trimethylindene is COc1cc2c(cc1OC)C(C)(C)C(C)=C2.
What is the InChIKey of 5,6-dimethoxy-1,1,2-trimethylindene?
The InChIKey is ASEWUMJXOFFUJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18O2/c1-9-6-10-7-12(15-4)13(16-5)8-11(10)14(9,2)3/h6-8H,1-5H3.
What are the key properties of 5,6-dimethoxy-1,1,2-trimethylindene?
5,6-dimethoxy-1,1,2-trimethylindene has a molecular weight of 218.30 g/mol, XLogP of 3.40, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dimethoxy-1,1,2-trimethylindene is sourced from PubChem (CID 23377407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).