2-(difluoromethoxy)ethoxymethylbenzene

C10H12F2O2 — CID 155234334

IUPAC2-(difluoromethoxy)ethoxymethylbenzene
SMILESFC(F)OCCOCc1ccccc1
InChIInChI=1S/C10H12F2O2/c11-10(12)14-7-6-13-8-9-4-2-1-3-5-9/h1-5,10H,6-8H2
InChIKeyPDFNMTMWEHXDEJ-UHFFFAOYSA-N
MW202.20 g/mol
LogP2.44
Rot. Bonds6

About 2-(difluoromethoxy)ethoxymethylbenzene

2-(difluoromethoxy)ethoxymethylbenzene (PubChem CID 155234334) has the molecular formula C10H12F2O2 and a molecular weight of 202.20 g/mol. Its IUPAC name is 2-(difluoromethoxy)ethoxymethylbenzene.

Molecular Properties

Compound Name2-(difluoromethoxy)ethoxymethylbenzene
PubChem CID155234334
Molecular FormulaC10H12F2O2
Molecular Weight202.20 g/mol
Exact Mass202.08
IUPAC Name2-(difluoromethoxy)ethoxymethylbenzene
SMILESFC(F)OCCOCc1ccccc1
InChIInChI=1S/C10H12F2O2/c11-10(12)14-7-6-13-8-9-4-2-1-3-5-9/h1-5,10H,6-8H2
InChIKeyPDFNMTMWEHXDEJ-UHFFFAOYSA-N
XLogP2.44
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.20
LogP ≤ 52.44
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

4-(difluoromethoxy)butoxymethylbenzene
CID 122164098
1-(2-phenylmethoxyethoxy)ethanol
CID 121292346
[(3R)-3-fluoro-3-iodopropoxy]methylbenzene
CID 125475539
2,3-difluoropropoxymethylbenzene
CID 86233522
5-[2-(5-phenylmethoxypentoxy)ethoxy]pentoxymethylbenzene
CID 135358353
2-octadecan-5-yloxyethoxymethylbenzene
CID 122548106
2-(2,2,2-trifluoroethoxy)ethoxymethylbenzene
CID 14221122
2-(trifluoromethoxy)ethoxymethylbenzene
CID 154682514
(2R)-2-fluoro-4-phenylmethoxybutan-1-ol
CID 129405204
2-[2-(2-methoxyethoxy)ethoxy]ethoxymethylbenzene
CID 15050635
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-phenylmethoxyethoxy)ethoxymethanol
CID 57257914

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethoxy)ethoxymethylbenzene?
The IUPAC name of 2-(difluoromethoxy)ethoxymethylbenzene (CID 155234334) is 2-(difluoromethoxy)ethoxymethylbenzene.
What is the SMILES notation for 2-(difluoromethoxy)ethoxymethylbenzene?
The canonical SMILES for 2-(difluoromethoxy)ethoxymethylbenzene is FC(F)OCCOCc1ccccc1.
What is the InChIKey of 2-(difluoromethoxy)ethoxymethylbenzene?
The InChIKey is PDFNMTMWEHXDEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F2O2/c11-10(12)14-7-6-13-8-9-4-2-1-3-5-9/h1-5,10H,6-8H2.
What are the key properties of 2-(difluoromethoxy)ethoxymethylbenzene?
2-(difluoromethoxy)ethoxymethylbenzene has a molecular weight of 202.20 g/mol, XLogP of 2.44, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethoxy)ethoxymethylbenzene is sourced from PubChem (CID 155234334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).