2-ethoxy-3-fluoro-2,3-dihydro-1-benzofuran

C10H11FO2 — CID 141453063

IUPAC2-ethoxy-3-fluoro-2,3-dihydro-1-benzofuran
SMILESCCOC1Oc2ccccc2C1F
InChIInChI=1S/C10H11FO2/c1-2-12-10-9(11)7-5-3-4-6-8(7)13-10/h3-6,9-10H,2H2,1H3
InChIKeyDSNMDQWUMWRYCY-UHFFFAOYSA-N
MW182.19 g/mol
LogP2.45
Rot. Bonds2

About 2-ethoxy-3-fluoro-2,3-dihydro-1-benzofuran

2-ethoxy-3-fluoro-2,3-dihydro-1-benzofuran (PubChem CID 141453063) has the molecular formula C10H11FO2 and a molecular weight of 182.19 g/mol. Its IUPAC name is 2-ethoxy-3-fluoro-2,3-dihydro-1-benzofuran.

Molecular Properties

Compound Name2-ethoxy-3-fluoro-2,3-dihydro-1-benzofuran
PubChem CID141453063
Molecular FormulaC10H11FO2
Molecular Weight182.19 g/mol
Exact Mass182.07
IUPAC Name2-ethoxy-3-fluoro-2,3-dihydro-1-benzofuran
SMILESCCOC1Oc2ccccc2C1F
InChIInChI=1S/C10H11FO2/c1-2-12-10-9(11)7-5-3-4-6-8(7)13-10/h3-6,9-10H,2H2,1H3
InChIKeyDSNMDQWUMWRYCY-UHFFFAOYSA-N
XLogP2.45
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.19
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2S,3R)-2-ethoxy-3-(4-fluorophenyl)-3,4-dihydro-2H-chromene
CID 138963771
(3S,4R)-4-ethoxy-2,2-dimethyl-3,4-dihydrochromen-3-ol
CID 177434477
(3R)-1-ethoxy-3-propan-2-yl-1,3-dihydro-2-benzofuran
CID 101412626
(2S,3R)-3-ethoxy-2-phenyl-2,3-dihydronaphtho[2,3-g][1,4]benzodioxine
CID 23262025
5-ethoxy-1-pyridin-2-yl-5,10b-dihydrochromeno[4,3-d]pyrimidine
CID 70554952
(4S)-2-(2-ethoxyphenyl)-3,4-dihydro-2H-chromen-4-ol
CID 104949924
7-oxabicyclo[4.2.0]octa-1,3,5-trien-8-yl formate
CID 123218550
(3R,4S)-3,4-dimethyl-3,4-dihydro-2H-chromen-2-ol
CID 164679988
9-methyl-9H-xanthene;propane
CID 143256907
1-[(2S,3R)-3-hydroxy-2,3-dihydro-1-benzofuran-2-yl]propan-1-one
CID 71445172
(3S)-3-butoxy-2-methyl-2,3-dihydro-1,4-benzodioxine
CID 154992776
ethyl 4H-chromene-4-carboxylate
CID 91620312

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-3-fluoro-2,3-dihydro-1-benzofuran?
The IUPAC name of 2-ethoxy-3-fluoro-2,3-dihydro-1-benzofuran (CID 141453063) is 2-ethoxy-3-fluoro-2,3-dihydro-1-benzofuran.
What is the SMILES notation for 2-ethoxy-3-fluoro-2,3-dihydro-1-benzofuran?
The canonical SMILES for 2-ethoxy-3-fluoro-2,3-dihydro-1-benzofuran is CCOC1Oc2ccccc2C1F.
What is the InChIKey of 2-ethoxy-3-fluoro-2,3-dihydro-1-benzofuran?
The InChIKey is DSNMDQWUMWRYCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FO2/c1-2-12-10-9(11)7-5-3-4-6-8(7)13-10/h3-6,9-10H,2H2,1H3.
What are the key properties of 2-ethoxy-3-fluoro-2,3-dihydro-1-benzofuran?
2-ethoxy-3-fluoro-2,3-dihydro-1-benzofuran has a molecular weight of 182.19 g/mol, XLogP of 2.45, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-3-fluoro-2,3-dihydro-1-benzofuran is sourced from PubChem (CID 141453063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).