[5-[(2,3-difluorophenoxy)methyl]furan-2-yl]methanol

C12H10F2O3 — CID 113372456

IUPAC[5-[(2,3-difluorophenoxy)methyl]furan-2-yl]methanol
SMILESOCc1ccc(COc2cccc(F)c2F)o1
InChIInChI=1S/C12H10F2O3/c13-10-2-1-3-11(12(10)14)16-7-9-5-4-8(6-15)17-9/h1-5,15H,6-7H2
InChIKeyLSIBIJSAWIUOSI-UHFFFAOYSA-N
MW240.20 g/mol
LogP2.63
Rot. Bonds4

About [5-[(2,3-difluorophenoxy)methyl]furan-2-yl]methanol

[5-[(2,3-difluorophenoxy)methyl]furan-2-yl]methanol (PubChem CID 113372456) has the molecular formula C12H10F2O3 and a molecular weight of 240.20 g/mol. Its IUPAC name is [5-[(2,3-difluorophenoxy)methyl]furan-2-yl]methanol.

Molecular Properties

Compound Name[5-[(2,3-difluorophenoxy)methyl]furan-2-yl]methanol
PubChem CID113372456
Molecular FormulaC12H10F2O3
Molecular Weight240.20 g/mol
Exact Mass240.06
IUPAC Name[5-[(2,3-difluorophenoxy)methyl]furan-2-yl]methanol
SMILESOCc1ccc(COc2cccc(F)c2F)o1
InChIInChI=1S/C12H10F2O3/c13-10-2-1-3-11(12(10)14)16-7-9-5-4-8(6-15)17-9/h1-5,15H,6-7H2
InChIKeyLSIBIJSAWIUOSI-UHFFFAOYSA-N
XLogP2.63
TPSA42.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.20
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[5-[(2,3-difluorophenoxy)methyl]furan-2-yl]-N-methylmethanamine
CID 63036465
[5-[(3-fluorophenoxy)methyl]furan-2-yl]methanol
CID 82080187
1-[[2-[(2,3-difluorophenoxy)methyl]phenyl]methoxy]-2,3-difluorobenzene
CID 174920306
5-[(2,3-difluorophenoxy)methyl]-1,2-oxazole-3-carbohydrazide
CID 55214004
3-(2,3-difluorophenoxy)propan-1-ol
CID 63037951
2-[(2,3-difluorophenoxy)methyl]-5-methyl-1,3-oxazole
CID 124587856
CID 175374084
CID 175374084
1-[7-(2,3-difluorophenoxy)heptoxy]-2,3-difluorobenzene
CID 71446254
N-[[5-[(2-fluorophenoxy)methyl]furan-2-yl]methyl]-2-methylpropan-2-amine
CID 62452473
3-(2,3-difluorophenoxy)propane-1,2-diol
CID 79838719
4-[(2,3-difluorophenoxy)methyl]pyridine
CID 141089252
2-(2,3-difluorophenoxy)ethanamine
CID 63036211

Frequently Asked Questions

What is the IUPAC name of [5-[(2,3-difluorophenoxy)methyl]furan-2-yl]methanol?
The IUPAC name of [5-[(2,3-difluorophenoxy)methyl]furan-2-yl]methanol (CID 113372456) is [5-[(2,3-difluorophenoxy)methyl]furan-2-yl]methanol.
What is the SMILES notation for [5-[(2,3-difluorophenoxy)methyl]furan-2-yl]methanol?
The canonical SMILES for [5-[(2,3-difluorophenoxy)methyl]furan-2-yl]methanol is OCc1ccc(COc2cccc(F)c2F)o1.
What is the InChIKey of [5-[(2,3-difluorophenoxy)methyl]furan-2-yl]methanol?
The InChIKey is LSIBIJSAWIUOSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10F2O3/c13-10-2-1-3-11(12(10)14)16-7-9-5-4-8(6-15)17-9/h1-5,15H,6-7H2.
What are the key properties of [5-[(2,3-difluorophenoxy)methyl]furan-2-yl]methanol?
[5-[(2,3-difluorophenoxy)methyl]furan-2-yl]methanol has a molecular weight of 240.20 g/mol, XLogP of 2.63, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[(2,3-difluorophenoxy)methyl]furan-2-yl]methanol is sourced from PubChem (CID 113372456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).