6-fluoro-3-(methoxymethyl)-1-benzofuran

C10H9FO2 — CID 117177694

IUPAC6-fluoro-3-(methoxymethyl)-1-benzofuran
SMILESCOCc1coc2cc(F)ccc12
InChIInChI=1S/C10H9FO2/c1-12-5-7-6-13-10-4-8(11)2-3-9(7)10/h2-4,6H,5H2,1H3
InChIKeyCUTHNFDARJDGJO-UHFFFAOYSA-N
MW180.18 g/mol
LogP2.72
Rot. Bonds2

About 6-fluoro-3-(methoxymethyl)-1-benzofuran

6-fluoro-3-(methoxymethyl)-1-benzofuran (PubChem CID 117177694) has the molecular formula C10H9FO2 and a molecular weight of 180.18 g/mol. Its IUPAC name is 6-fluoro-3-(methoxymethyl)-1-benzofuran.

Molecular Properties

Compound Name6-fluoro-3-(methoxymethyl)-1-benzofuran
PubChem CID117177694
Molecular FormulaC10H9FO2
Molecular Weight180.18 g/mol
Exact Mass180.06
IUPAC Name6-fluoro-3-(methoxymethyl)-1-benzofuran
SMILESCOCc1coc2cc(F)ccc12
InChIInChI=1S/C10H9FO2/c1-12-5-7-6-13-10-4-8(11)2-3-9(7)10/h2-4,6H,5H2,1H3
InChIKeyCUTHNFDARJDGJO-UHFFFAOYSA-N
XLogP2.72
TPSA22.37 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.18
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(6-fluoro-1-benzofuran-3-yl)methyl formate
CID 91089141
1-(6-fluoro-1-benzofuran-3-yl)-N,N-dimethylmethanamine
CID 117177542
5-chloro-3-(methoxymethyl)-1-benzofuran
CID 117174343
5-fluoro-3-[(4-methoxyphenoxy)methyl]-1-benzofuran
CID 117174312
4-[(6-fluoro-1-benzofuran-3-yl)methyl]piperidine
CID 71261709
6-chloro-3-[(2-fluorophenoxy)methyl]-1-benzofuran
CID 117177608
4-fluoro-2-(methoxymethyl)aniline;hydrochloride
CID 75481190
[5-fluoro-2-(methoxymethyl)phenyl]methanamine
CID 63289386
(3S)-3-[(6-fluoro-1-benzofuran-3-yl)methyl]piperidine
CID 176570011
5-fluoro-3-(methylsulfanylmethyl)-1-benzofuran
CID 117174338
N'-[2-(4-fluorophenoxy)acetyl]-2-(6-methyl-1-benzofuran-3-yl)acetohydrazide
CID 18158747
3-(chloromethyl)-5-fluoro-1-benzofuran
CID 18184314

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-3-(methoxymethyl)-1-benzofuran?
The IUPAC name of 6-fluoro-3-(methoxymethyl)-1-benzofuran (CID 117177694) is 6-fluoro-3-(methoxymethyl)-1-benzofuran.
What is the SMILES notation for 6-fluoro-3-(methoxymethyl)-1-benzofuran?
The canonical SMILES for 6-fluoro-3-(methoxymethyl)-1-benzofuran is COCc1coc2cc(F)ccc12.
What is the InChIKey of 6-fluoro-3-(methoxymethyl)-1-benzofuran?
The InChIKey is CUTHNFDARJDGJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FO2/c1-12-5-7-6-13-10-4-8(11)2-3-9(7)10/h2-4,6H,5H2,1H3.
What are the key properties of 6-fluoro-3-(methoxymethyl)-1-benzofuran?
6-fluoro-3-(methoxymethyl)-1-benzofuran has a molecular weight of 180.18 g/mol, XLogP of 2.72, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-3-(methoxymethyl)-1-benzofuran is sourced from PubChem (CID 117177694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).