3-ethyl-4,6-difluoro-2,3-dihydro-1-benzofuran

C10H10F2O — CID 171497212

IUPAC3-ethyl-4,6-difluoro-2,3-dihydro-1-benzofuran
SMILESCCC1COc2cc(F)cc(F)c21
InChIInChI=1S/C10H10F2O/c1-2-6-5-13-9-4-7(11)3-8(12)10(6)9/h3-4,6H,2,5H2,1H3
InChIKeyHFXYIUOBFZRIHT-UHFFFAOYSA-N
MW184.19 g/mol
LogP2.85
Rot. Bonds1

About 3-ethyl-4,6-difluoro-2,3-dihydro-1-benzofuran

3-ethyl-4,6-difluoro-2,3-dihydro-1-benzofuran (PubChem CID 171497212) has the molecular formula C10H10F2O and a molecular weight of 184.19 g/mol. Its IUPAC name is 3-ethyl-4,6-difluoro-2,3-dihydro-1-benzofuran.

Molecular Properties

Compound Name3-ethyl-4,6-difluoro-2,3-dihydro-1-benzofuran
PubChem CID171497212
Molecular FormulaC10H10F2O
Molecular Weight184.19 g/mol
Exact Mass184.07
IUPAC Name3-ethyl-4,6-difluoro-2,3-dihydro-1-benzofuran
SMILESCCC1COc2cc(F)cc(F)c21
InChIInChI=1S/C10H10F2O/c1-2-6-5-13-9-4-7(11)3-8(12)10(6)9/h3-4,6H,2,5H2,1H3
InChIKeyHFXYIUOBFZRIHT-UHFFFAOYSA-N
XLogP2.85
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.19
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4,6-difluoro-2,3-dihydro-1-benzofuran-3-amine;hydrochloride
CID 75480738
5,7-difluoro-N,3-dimethyl-3,4-dihydro-2H-chromen-4-amine
CID 82234747
N-cyclopropyl-4,6-difluoro-2,3-dihydro-1-benzofuran-3-amine
CID 62786136
(1aR,7bS)-5,7-difluoro-1,1a,2,7b-tetrahydrocyclopropa[c]chromene-1-carboxylic acid
CID 67175553
benzyl N-(4,6-difluoro-2,3-dihydro-1-benzofuran-3-yl)carbamate
CID 172615311
(3R)-3-amino-6-fluoro-2,3-dihydro-1-benzofuran-4-carboxylic acid
CID 131128284
N-ethyl-4,6-difluoro-2-methyl-2,3-dihydro-1-benzofuran-3-amine
CID 62784825
(5,7-difluoro-3,4-dihydro-2H-1,4-benzoxazin-3-yl)methanamine
CID 84619648
N-[(3R)-4,6-difluoro-2,3-dihydro-1-benzofuran-3-yl]-5-ethyl-1-(2-methylpropyl)pyrazole-4-carboxamide
CID 124861480
1-[(3S)-4,6-difluoro-2,3-dihydro-1-benzofuran-3-yl]-3-[(2S)-1-hydroxy-3-phenylpropan-2-yl]urea
CID 99778476
1-(4-fluoro-2,3-dihydro-1-benzofuran-3-yl)-2-methylpropan-2-ol
CID 117199656
4,6-difluoro-N-methyl-2-propyl-2,3-dihydro-1-benzofuran-3-amine
CID 83049517

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-4,6-difluoro-2,3-dihydro-1-benzofuran?
The IUPAC name of 3-ethyl-4,6-difluoro-2,3-dihydro-1-benzofuran (CID 171497212) is 3-ethyl-4,6-difluoro-2,3-dihydro-1-benzofuran.
What is the SMILES notation for 3-ethyl-4,6-difluoro-2,3-dihydro-1-benzofuran?
The canonical SMILES for 3-ethyl-4,6-difluoro-2,3-dihydro-1-benzofuran is CCC1COc2cc(F)cc(F)c21.
What is the InChIKey of 3-ethyl-4,6-difluoro-2,3-dihydro-1-benzofuran?
The InChIKey is HFXYIUOBFZRIHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F2O/c1-2-6-5-13-9-4-7(11)3-8(12)10(6)9/h3-4,6H,2,5H2,1H3.
What are the key properties of 3-ethyl-4,6-difluoro-2,3-dihydro-1-benzofuran?
3-ethyl-4,6-difluoro-2,3-dihydro-1-benzofuran has a molecular weight of 184.19 g/mol, XLogP of 2.85, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-4,6-difluoro-2,3-dihydro-1-benzofuran is sourced from PubChem (CID 171497212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).