6-ethyl-2,3-dimethyl-1-benzofuran

C12H14O — CID 121007663

IUPAC6-ethyl-2,3-dimethyl-1-benzofuran
SMILESCCc1ccc2c(C)c(C)oc2c1
InChIInChI=1S/C12H14O/c1-4-10-5-6-11-8(2)9(3)13-12(11)7-10/h5-7H,4H2,1-3H3
InChIKeyUIPCLFZTJHVADT-UHFFFAOYSA-N
MW174.24 g/mol
LogP3.61
Rot. Bonds1

About 6-ethyl-2,3-dimethyl-1-benzofuran

6-ethyl-2,3-dimethyl-1-benzofuran (PubChem CID 121007663) has the molecular formula C12H14O and a molecular weight of 174.24 g/mol. Its IUPAC name is 6-ethyl-2,3-dimethyl-1-benzofuran.

Molecular Properties

Compound Name6-ethyl-2,3-dimethyl-1-benzofuran
PubChem CID121007663
Molecular FormulaC12H14O
Molecular Weight174.24 g/mol
Exact Mass174.10
IUPAC Name6-ethyl-2,3-dimethyl-1-benzofuran
SMILESCCc1ccc2c(C)c(C)oc2c1
InChIInChI=1S/C12H14O/c1-4-10-5-6-11-8(2)9(3)13-12(11)7-10/h5-7H,4H2,1-3H3
InChIKeyUIPCLFZTJHVADT-UHFFFAOYSA-N
XLogP3.61
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.24
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-[(2,3-dimethyl-1-benzofuran-6-yl)methyl]cyclopropan-1-ol
CID 117308163
3-ethyldibenzofuran
CID 58510747
7-ethyl-4-methylchromen-2-one
CID 5160585
7-ethyl-4-methyl-3-(3-methylbutan-2-yl)chromen-2-one
CID 91500291
2,3,6,7-tetramethylfuro[2,3-f][1]benzofuran
CID 170670996
6-ethyl-3-methyl-1-benzofuran
CID 45122551
1,7-diethyldibenzofuran
CID 135251716
ethyl 7-ethyl-4-oxochromene-2-carboxylate
CID 22924455
2-(2,3-dimethyl-1-benzofuran-6-yl)propan-1-ol
CID 117292658
2,3-bis(ethenyl)-6-ethyl-1-benzofuran;ethane
CID 142061376
5-ethyl-2,3-dimethyl-1-benzofuran-6-ol
CID 130033144
1-(2,3-dimethyl-1-benzofuran-6-yl)cyclopropan-1-ol
CID 117290840

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-2,3-dimethyl-1-benzofuran?
The IUPAC name of 6-ethyl-2,3-dimethyl-1-benzofuran (CID 121007663) is 6-ethyl-2,3-dimethyl-1-benzofuran.
What is the SMILES notation for 6-ethyl-2,3-dimethyl-1-benzofuran?
The canonical SMILES for 6-ethyl-2,3-dimethyl-1-benzofuran is CCc1ccc2c(C)c(C)oc2c1.
What is the InChIKey of 6-ethyl-2,3-dimethyl-1-benzofuran?
The InChIKey is UIPCLFZTJHVADT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14O/c1-4-10-5-6-11-8(2)9(3)13-12(11)7-10/h5-7H,4H2,1-3H3.
What are the key properties of 6-ethyl-2,3-dimethyl-1-benzofuran?
6-ethyl-2,3-dimethyl-1-benzofuran has a molecular weight of 174.24 g/mol, XLogP of 3.61, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2,3-dimethyl-1-benzofuran is sourced from PubChem (CID 121007663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).