6-methoxy-2,2-dimethylchromene

C12H14O2 — CID 11745424

IUPAC6-methoxy-2,2-dimethylchromene
SMILESCOc1ccc2c(c1)C=CC(C)(C)O2
InChIInChI=1S/C12H14O2/c1-12(2)7-6-9-8-10(13-3)4-5-11(9)14-12/h4-8H,1-3H3
InChIKeyGBNGEWROXPPBOJ-UHFFFAOYSA-N
MW190.24 g/mol
LogP2.88
Rot. Bonds1

About 6-methoxy-2,2-dimethylchromene

6-methoxy-2,2-dimethylchromene (PubChem CID 11745424) has the molecular formula C12H14O2 and a molecular weight of 190.24 g/mol. Its IUPAC name is 6-methoxy-2,2-dimethylchromene.

Molecular Properties

Compound Name6-methoxy-2,2-dimethylchromene
PubChem CID11745424
Molecular FormulaC12H14O2
Molecular Weight190.24 g/mol
Exact Mass190.10
IUPAC Name6-methoxy-2,2-dimethylchromene
SMILESCOc1ccc2c(c1)C=CC(C)(C)O2
InChIInChI=1S/C12H14O2/c1-12(2)7-6-9-8-10(13-3)4-5-11(9)14-12/h4-8H,1-3H3
InChIKeyGBNGEWROXPPBOJ-UHFFFAOYSA-N
XLogP2.88
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.24
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2,2-dimethylchromene?
The IUPAC name of 6-methoxy-2,2-dimethylchromene (CID 11745424) is 6-methoxy-2,2-dimethylchromene.
What is the SMILES notation for 6-methoxy-2,2-dimethylchromene?
The canonical SMILES for 6-methoxy-2,2-dimethylchromene is COc1ccc2c(c1)C=CC(C)(C)O2.
What is the InChIKey of 6-methoxy-2,2-dimethylchromene?
The InChIKey is GBNGEWROXPPBOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14O2/c1-12(2)7-6-9-8-10(13-3)4-5-11(9)14-12/h4-8H,1-3H3.
What are the key properties of 6-methoxy-2,2-dimethylchromene?
6-methoxy-2,2-dimethylchromene has a molecular weight of 190.24 g/mol, XLogP of 2.88, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2,2-dimethylchromene is sourced from PubChem (CID 11745424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).