3-[(2-fluoro-3-methylphenoxy)methyl]furan

C12H11FO2 — CID 107661892

IUPAC3-[(2-fluoro-3-methylphenoxy)methyl]furan
SMILESCc1cccc(OCc2ccoc2)c1F
InChIInChI=1S/C12H11FO2/c1-9-3-2-4-11(12(9)13)15-8-10-5-6-14-7-10/h2-7H,8H2,1H3
InChIKeyQRBZBTRYRGKYIG-UHFFFAOYSA-N
MW206.22 g/mol
LogP3.31
Rot. Bonds3

About 3-[(2-fluoro-3-methylphenoxy)methyl]furan

3-[(2-fluoro-3-methylphenoxy)methyl]furan (PubChem CID 107661892) has the molecular formula C12H11FO2 and a molecular weight of 206.22 g/mol. Its IUPAC name is 3-[(2-fluoro-3-methylphenoxy)methyl]furan.

Molecular Properties

Compound Name3-[(2-fluoro-3-methylphenoxy)methyl]furan
PubChem CID107661892
Molecular FormulaC12H11FO2
Molecular Weight206.22 g/mol
Exact Mass206.07
IUPAC Name3-[(2-fluoro-3-methylphenoxy)methyl]furan
SMILESCc1cccc(OCc2ccoc2)c1F
InChIInChI=1S/C12H11FO2/c1-9-3-2-4-11(12(9)13)15-8-10-5-6-14-7-10/h2-7H,8H2,1H3
InChIKeyQRBZBTRYRGKYIG-UHFFFAOYSA-N
XLogP3.31
TPSA22.37 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.22
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-[(2-fluoro-3-methylphenoxy)methyl]pyridine
CID 107661921
2-(furan-3-ylmethoxy)phenol
CID 83172625
2-[(2-fluoro-3-methylphenoxy)methyl]furan
CID 107661924
1,2-difluoro-3-[(2-fluoro-3-methylphenoxy)methyl]benzene
CID 107661926
1-ethoxy-2-fluoro-3-methylbenzene
CID 59732440
2-fluoro-1-[(3-fluoro-5-nitrophenyl)methoxy]-3-methylbenzene
CID 107662043
2-bromo-5-[(2-fluoro-3-methylphenoxy)methyl]aniline
CID 107656270
3-[(2-fluoro-3-methylphenoxy)methyl]benzoic acid
CID 113435752
3-[4-[(2-fluoro-3-methylphenoxy)methyl]phenyl]prop-2-yn-1-ol
CID 107660278
5-bromo-3-[2-fluoro-6-(furan-3-ylmethoxy)phenyl]-6-(furan-3-ylmethoxy)-2-methylpyrimidin-4-one
CID 21089573
4-[(2-fluoro-3-methylphenoxy)methyl]-3,5-dimethyl-1,2-oxazole
CID 103988426
2-[4-[(2-fluoro-3-methylphenoxy)methyl]phenyl]-N-methylpropan-1-amine
CID 107661159

Frequently Asked Questions

What is the IUPAC name of 3-[(2-fluoro-3-methylphenoxy)methyl]furan?
The IUPAC name of 3-[(2-fluoro-3-methylphenoxy)methyl]furan (CID 107661892) is 3-[(2-fluoro-3-methylphenoxy)methyl]furan.
What is the SMILES notation for 3-[(2-fluoro-3-methylphenoxy)methyl]furan?
The canonical SMILES for 3-[(2-fluoro-3-methylphenoxy)methyl]furan is Cc1cccc(OCc2ccoc2)c1F.
What is the InChIKey of 3-[(2-fluoro-3-methylphenoxy)methyl]furan?
The InChIKey is QRBZBTRYRGKYIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11FO2/c1-9-3-2-4-11(12(9)13)15-8-10-5-6-14-7-10/h2-7H,8H2,1H3.
What are the key properties of 3-[(2-fluoro-3-methylphenoxy)methyl]furan?
3-[(2-fluoro-3-methylphenoxy)methyl]furan has a molecular weight of 206.22 g/mol, XLogP of 3.31, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-fluoro-3-methylphenoxy)methyl]furan is sourced from PubChem (CID 107661892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).