2-[2-(2-methoxyphenoxy)-5-(trifluoromethyl)phenyl]furan

C18H13F3O3 — CID 168524965

IUPAC2-[2-(2-methoxyphenoxy)-5-(trifluoromethyl)phenyl]furan
SMILESCOc1ccccc1Oc1ccc(C(F)(F)F)cc1-c1ccco1
InChIInChI=1S/C18H13F3O3/c1-22-16-5-2-3-6-17(16)24-15-9-8-12(18(19,20)21)11-13(15)14-7-4-10-23-14/h2-11H,1H3
InChIKeyORHSXVIODUMCRG-UHFFFAOYSA-N
MW334.29 g/mol
LogP5.77
Rot. Bonds4

About 2-[2-(2-methoxyphenoxy)-5-(trifluoromethyl)phenyl]furan

2-[2-(2-methoxyphenoxy)-5-(trifluoromethyl)phenyl]furan (PubChem CID 168524965) has the molecular formula C18H13F3O3 and a molecular weight of 334.29 g/mol. Its IUPAC name is 2-[2-(2-methoxyphenoxy)-5-(trifluoromethyl)phenyl]furan.

Molecular Properties

Compound Name2-[2-(2-methoxyphenoxy)-5-(trifluoromethyl)phenyl]furan
PubChem CID168524965
Molecular FormulaC18H13F3O3
Molecular Weight334.29 g/mol
Exact Mass334.08
IUPAC Name2-[2-(2-methoxyphenoxy)-5-(trifluoromethyl)phenyl]furan
SMILESCOc1ccccc1Oc1ccc(C(F)(F)F)cc1-c1ccco1
InChIInChI=1S/C18H13F3O3/c1-22-16-5-2-3-6-17(16)24-15-9-8-12(18(19,20)21)11-13(15)14-7-4-10-23-14/h2-11H,1H3
InChIKeyORHSXVIODUMCRG-UHFFFAOYSA-N
XLogP5.77
TPSA31.60 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500334.29
LogP ≤ 55.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(4-phenylphenoxy)-5-(trifluoromethyl)phenyl]furan
CID 168525850
2-[2-(4-chloro-3,5-dimethylphenoxy)-5-(trifluoromethyl)phenyl]furan
CID 168524769
2-[2-(2,2,2-trifluoroethoxy)-5-(trifluoromethyl)phenyl]furan
CID 168528176
3-chloro-2-[2-(furan-2-yl)phenoxy]-5-(trifluoromethyl)pyridine
CID 168524801
2-[2-fluoro-4-(trifluoromethyl)phenyl]furan
CID 168524503
1-methoxy-2-[4-(trifluoromethyl)phenoxy]benzene
CID 76546119
2-[2-nitro-5-(trifluoromethyl)phenyl]furan
CID 168526595
2-[4-methoxy-3-(trifluoromethoxy)phenyl]furan
CID 168525465
1-[2-(furan-2-yl)-4-(trifluoromethyl)phenyl]-4-methylpiperazine
CID 168525964
1-(diaminomethylidene)-2-[2-(2-methoxyphenoxy)-5-(trifluoromethyl)phenyl]guanidine
CID 168602079
2-[2-methoxy-4-(trifluoromethoxy)phenyl]furan
CID 168525707
1-[2-(furan-2-yl)-4-(trifluoromethyl)phenyl]pyrrolidine
CID 168524729

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-methoxyphenoxy)-5-(trifluoromethyl)phenyl]furan?
The IUPAC name of 2-[2-(2-methoxyphenoxy)-5-(trifluoromethyl)phenyl]furan (CID 168524965) is 2-[2-(2-methoxyphenoxy)-5-(trifluoromethyl)phenyl]furan.
What is the SMILES notation for 2-[2-(2-methoxyphenoxy)-5-(trifluoromethyl)phenyl]furan?
The canonical SMILES for 2-[2-(2-methoxyphenoxy)-5-(trifluoromethyl)phenyl]furan is COc1ccccc1Oc1ccc(C(F)(F)F)cc1-c1ccco1.
What is the InChIKey of 2-[2-(2-methoxyphenoxy)-5-(trifluoromethyl)phenyl]furan?
The InChIKey is ORHSXVIODUMCRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13F3O3/c1-22-16-5-2-3-6-17(16)24-15-9-8-12(18(19,20)21)11-13(15)14-7-4-10-23-14/h2-11H,1H3.
What are the key properties of 2-[2-(2-methoxyphenoxy)-5-(trifluoromethyl)phenyl]furan?
2-[2-(2-methoxyphenoxy)-5-(trifluoromethyl)phenyl]furan has a molecular weight of 334.29 g/mol, XLogP of 5.77, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-methoxyphenoxy)-5-(trifluoromethyl)phenyl]furan is sourced from PubChem (CID 168524965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).