2-[2-(2,5-difluorophenoxy)ethoxy]ethanol

C10H12F2O3 — CID 63268776

IUPAC2-[2-(2,5-difluorophenoxy)ethoxy]ethanol
SMILESOCCOCCOc1cc(F)ccc1F
InChIInChI=1S/C10H12F2O3/c11-8-1-2-9(12)10(7-8)15-6-5-14-4-3-13/h1-2,7,13H,3-6H2
InChIKeyPELFNYHWGNJITJ-UHFFFAOYSA-N
MW218.20 g/mol
LogP1.35
Rot. Bonds6

About 2-[2-(2,5-difluorophenoxy)ethoxy]ethanol

2-[2-(2,5-difluorophenoxy)ethoxy]ethanol (PubChem CID 63268776) has the molecular formula C10H12F2O3 and a molecular weight of 218.20 g/mol. Its IUPAC name is 2-[2-(2,5-difluorophenoxy)ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-(2,5-difluorophenoxy)ethoxy]ethanol
PubChem CID63268776
Molecular FormulaC10H12F2O3
Molecular Weight218.20 g/mol
Exact Mass218.08
IUPAC Name2-[2-(2,5-difluorophenoxy)ethoxy]ethanol
SMILESOCCOCCOc1cc(F)ccc1F
InChIInChI=1S/C10H12F2O3/c11-8-1-2-9(12)10(7-8)15-6-5-14-4-3-13/h1-2,7,13H,3-6H2
InChIKeyPELFNYHWGNJITJ-UHFFFAOYSA-N
XLogP1.35
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.20
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

6-(2,5-difluorophenoxy)hexan-1-ol
CID 103867914
2-[2-[4,5,8-tris[2-(2-hydroxyethoxy)ethoxy]anthracen-1-yl]oxyethoxy]ethanol
CID 89126006
1,4-difluoro-2-hexoxybenzene
CID 23437312
3-(2,5-difluorophenoxy)propanenitrile
CID 63269641
3-(2,5-difluorophenoxy)propanal
CID 63269959
2-[2-(3-bromo-4-fluorophenoxy)ethoxy]ethanol
CID 83236273
2-[2-(3-chloro-2-fluorophenoxy)ethoxy]ethanol
CID 116689707
4-[2-(2,5-difluorophenoxy)ethoxy]benzenecarbothioamide
CID 63269646
3-(2,5-difluorophenoxy)-N'-hydroxypropanimidamide
CID 76992494
6-(2,5-difluorophenoxy)hexan-3-ol
CID 106802707
3-(2,5-difluorophenoxy)propanimidamide
CID 63269341
2-[2-[4,5-diamino-2-[2-(2-hydroxyethoxy)ethoxy]phenoxy]ethoxy]ethanol
CID 163651325

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2,5-difluorophenoxy)ethoxy]ethanol?
The IUPAC name of 2-[2-(2,5-difluorophenoxy)ethoxy]ethanol (CID 63268776) is 2-[2-(2,5-difluorophenoxy)ethoxy]ethanol.
What is the SMILES notation for 2-[2-(2,5-difluorophenoxy)ethoxy]ethanol?
The canonical SMILES for 2-[2-(2,5-difluorophenoxy)ethoxy]ethanol is OCCOCCOc1cc(F)ccc1F.
What is the InChIKey of 2-[2-(2,5-difluorophenoxy)ethoxy]ethanol?
The InChIKey is PELFNYHWGNJITJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F2O3/c11-8-1-2-9(12)10(7-8)15-6-5-14-4-3-13/h1-2,7,13H,3-6H2.
What are the key properties of 2-[2-(2,5-difluorophenoxy)ethoxy]ethanol?
2-[2-(2,5-difluorophenoxy)ethoxy]ethanol has a molecular weight of 218.20 g/mol, XLogP of 1.35, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2,5-difluorophenoxy)ethoxy]ethanol is sourced from PubChem (CID 63268776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).