6-(difluoromethoxy)-2,3-dihydro-1-benzofuran

C9H8F2O2 — CID 177206683

IUPAC6-(difluoromethoxy)-2,3-dihydro-1-benzofuran
SMILESFC(F)Oc1ccc2c(c1)OCC2
InChIInChI=1S/C9H8F2O2/c10-9(11)13-7-2-1-6-3-4-12-8(6)5-7/h1-2,5,9H,3-4H2
InChIKeyKGOLIYRVZPISIF-UHFFFAOYSA-N
MW186.16 g/mol
LogP2.22
Rot. Bonds2

About 6-(difluoromethoxy)-2,3-dihydro-1-benzofuran

6-(difluoromethoxy)-2,3-dihydro-1-benzofuran (PubChem CID 177206683) has the molecular formula C9H8F2O2 and a molecular weight of 186.16 g/mol. Its IUPAC name is 6-(difluoromethoxy)-2,3-dihydro-1-benzofuran.

Molecular Properties

Compound Name6-(difluoromethoxy)-2,3-dihydro-1-benzofuran
PubChem CID177206683
Molecular FormulaC9H8F2O2
Molecular Weight186.16 g/mol
Exact Mass186.05
IUPAC Name6-(difluoromethoxy)-2,3-dihydro-1-benzofuran
SMILESFC(F)Oc1ccc2c(c1)OCC2
InChIInChI=1S/C9H8F2O2/c10-9(11)13-7-2-1-6-3-4-12-8(6)5-7/h1-2,5,9H,3-4H2
InChIKeyKGOLIYRVZPISIF-UHFFFAOYSA-N
XLogP2.22
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.16
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6-(difluoromethoxy)-1,2,3,4-tetrahydronaphthalene
CID 82076236
2,3-dihydro-1-benzofuran-6-yl benzoate
CID 90777850
N-[[4-(difluoromethoxy)phenyl]methyl]-2,3-dihydro-1-benzofuran-5-amine
CID 43732620
(3R)-3-bromo-7-(difluoromethoxy)-2,3-dihydrochromen-4-one
CID 177204677
6-(difluoromethoxy)-2,3-dihydro-1-benzofuran-3-amine
CID 63097077
2,3-dihydro-1-benzofuran-6-yl(pentafluoro)-λ6-sulfane
CID 164867478
3-(2,3-dihydro-1-benzofuran-6-yloxy)pyrrolidine
CID 84673192
6-(2-chloroethyl)-2,3-dihydro-1-benzofuran
CID 130750027
(3R,4R)-3-bromo-7-(difluoromethoxy)-3,4-dihydro-2H-chromen-4-ol
CID 177204858
2,7-bis(difluoromethoxy)naphthalene
CID 119024038
1-(2,3-dihydro-1-benzofuran-6-yl)ethanamine;hydrochloride
CID 91758963
acetic acid;6-methyl-2,3-dihydro-1-benzofuran
CID 156753873

Frequently Asked Questions

What is the IUPAC name of 6-(difluoromethoxy)-2,3-dihydro-1-benzofuran?
The IUPAC name of 6-(difluoromethoxy)-2,3-dihydro-1-benzofuran (CID 177206683) is 6-(difluoromethoxy)-2,3-dihydro-1-benzofuran.
What is the SMILES notation for 6-(difluoromethoxy)-2,3-dihydro-1-benzofuran?
The canonical SMILES for 6-(difluoromethoxy)-2,3-dihydro-1-benzofuran is FC(F)Oc1ccc2c(c1)OCC2.
What is the InChIKey of 6-(difluoromethoxy)-2,3-dihydro-1-benzofuran?
The InChIKey is KGOLIYRVZPISIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8F2O2/c10-9(11)13-7-2-1-6-3-4-12-8(6)5-7/h1-2,5,9H,3-4H2.
What are the key properties of 6-(difluoromethoxy)-2,3-dihydro-1-benzofuran?
6-(difluoromethoxy)-2,3-dihydro-1-benzofuran has a molecular weight of 186.16 g/mol, XLogP of 2.22, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(difluoromethoxy)-2,3-dihydro-1-benzofuran is sourced from PubChem (CID 177206683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).