2-(trifluoromethoxy)ethoxymethylbenzene

C10H11F3O2 — CID 154682514

IUPAC2-(trifluoromethoxy)ethoxymethylbenzene
SMILESFC(F)(F)OCCOCc1ccccc1
InChIInChI=1S/C10H11F3O2/c11-10(12,13)15-7-6-14-8-9-4-2-1-3-5-9/h1-5H,6-8H2
InChIKeyZWBKXELJAXGUBG-UHFFFAOYSA-N
MW220.19 g/mol
LogP2.74
Rot. Bonds5

About 2-(trifluoromethoxy)ethoxymethylbenzene

2-(trifluoromethoxy)ethoxymethylbenzene (PubChem CID 154682514) has the molecular formula C10H11F3O2 and a molecular weight of 220.19 g/mol. Its IUPAC name is 2-(trifluoromethoxy)ethoxymethylbenzene.

Molecular Properties

Compound Name2-(trifluoromethoxy)ethoxymethylbenzene
PubChem CID154682514
Molecular FormulaC10H11F3O2
Molecular Weight220.19 g/mol
Exact Mass220.07
IUPAC Name2-(trifluoromethoxy)ethoxymethylbenzene
SMILESFC(F)(F)OCCOCc1ccccc1
InChIInChI=1S/C10H11F3O2/c11-10(12,13)15-7-6-14-8-9-4-2-1-3-5-9/h1-5H,6-8H2
InChIKeyZWBKXELJAXGUBG-UHFFFAOYSA-N
XLogP2.74
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.19
LogP ≤ 52.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(2,2,2-trifluoroethoxy)ethoxymethylbenzene
CID 14221122
[diphenyl(2-phenylmethoxyethoxy)methyl]benzene
CID 99938038
2-(trifluoromethylsulfanyloxy)ethoxymethylbenzene
CID 146493761
2-fluoro-2-(phenylmethoxymethyl)propanedioic acid
CID 67878922
5-[2-(5-phenylmethoxypentoxy)ethoxy]pentoxymethylbenzene
CID 135358353
2-(difluoromethoxy)ethoxymethylbenzene
CID 155234334
3-phenylmethoxypropyl trifluoromethanesulfonate
CID 56850444
2-(2-phenylmethoxyethoxy)ethoxymethanol
CID 57257914
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-propoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxymethylbenzene
CID 153014245
2-[2-(2-methoxyethoxy)ethoxy]ethoxymethylbenzene
CID 15050635
trifluoro-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethoxymethyl]boranuide
CID 91659041
12-(trifluoromethoxy)dodecylbenzene
CID 59366570

Frequently Asked Questions

What is the IUPAC name of 2-(trifluoromethoxy)ethoxymethylbenzene?
The IUPAC name of 2-(trifluoromethoxy)ethoxymethylbenzene (CID 154682514) is 2-(trifluoromethoxy)ethoxymethylbenzene.
What is the SMILES notation for 2-(trifluoromethoxy)ethoxymethylbenzene?
The canonical SMILES for 2-(trifluoromethoxy)ethoxymethylbenzene is FC(F)(F)OCCOCc1ccccc1.
What is the InChIKey of 2-(trifluoromethoxy)ethoxymethylbenzene?
The InChIKey is ZWBKXELJAXGUBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F3O2/c11-10(12,13)15-7-6-14-8-9-4-2-1-3-5-9/h1-5H,6-8H2.
What are the key properties of 2-(trifluoromethoxy)ethoxymethylbenzene?
2-(trifluoromethoxy)ethoxymethylbenzene has a molecular weight of 220.19 g/mol, XLogP of 2.74, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(trifluoromethoxy)ethoxymethylbenzene is sourced from PubChem (CID 154682514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).