2,2-difluoro-1-[4-(2-methoxyethyl)phenyl]ethanol

C11H14F2O2 — CID 104632700

IUPAC2,2-difluoro-1-[4-(2-methoxyethyl)phenyl]ethanol
SMILESCOCCc1ccc(C(O)C(F)F)cc1
InChIInChI=1S/C11H14F2O2/c1-15-7-6-8-2-4-9(5-3-8)10(14)11(12)13/h2-5,10-11,14H,6-7H2,1H3
InChIKeyJBHUKZRSZDGPSB-UHFFFAOYSA-N
MW216.23 g/mol
LogP2.17
Rot. Bonds5

About 2,2-difluoro-1-[4-(2-methoxyethyl)phenyl]ethanol

2,2-difluoro-1-[4-(2-methoxyethyl)phenyl]ethanol (PubChem CID 104632700) has the molecular formula C11H14F2O2 and a molecular weight of 216.23 g/mol. Its IUPAC name is 2,2-difluoro-1-[4-(2-methoxyethyl)phenyl]ethanol.

Molecular Properties

Compound Name2,2-difluoro-1-[4-(2-methoxyethyl)phenyl]ethanol
PubChem CID104632700
Molecular FormulaC11H14F2O2
Molecular Weight216.23 g/mol
Exact Mass216.10
IUPAC Name2,2-difluoro-1-[4-(2-methoxyethyl)phenyl]ethanol
SMILESCOCCc1ccc(C(O)C(F)F)cc1
InChIInChI=1S/C11H14F2O2/c1-15-7-6-8-2-4-9(5-3-8)10(14)11(12)13/h2-5,10-11,14H,6-7H2,1H3
InChIKeyJBHUKZRSZDGPSB-UHFFFAOYSA-N
XLogP2.17
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.23
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[4-(2-methoxyethyl)phenyl]-2-phenylbutan-1-ol
CID 61099739
(4-chlorophenyl)-[4-(2-methoxyethyl)phenyl]methanol
CID 55133393
(3,4-difluorophenyl)-[4-(2-methoxyethyl)phenyl]methanol
CID 61099736
(2-fluorophenyl)-[4-(2-methoxyethyl)phenyl]methanol
CID 61099399
(4-fluorophenyl)-[4-(2-methoxyethyl)phenyl]methanamine
CID 43198335
1-[bromo-(4-fluorophenyl)methyl]-4-(2-methoxyethyl)benzene
CID 61096683
(5-chloro-2-fluorophenyl)-[4-(2-methoxyethyl)phenyl]methanol
CID 61099907
(2,6-difluoro-3-methylphenyl)-[4-(2-methoxyethyl)phenyl]methanol
CID 82799843
[4-(2-methoxyethyl)phenyl]-thiophen-2-ylmethanol
CID 55133973
3-methoxy-2-methyl-1-(4-propylphenyl)propan-1-ol
CID 116502564
1-(1-chloro-3,3,3-trifluoropropyl)-4-(2-methoxyethyl)benzene
CID 55134945
(4-ethylphenyl)-[4-(2-methoxyethyl)phenyl]methanamine
CID 43198378

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-1-[4-(2-methoxyethyl)phenyl]ethanol?
The IUPAC name of 2,2-difluoro-1-[4-(2-methoxyethyl)phenyl]ethanol (CID 104632700) is 2,2-difluoro-1-[4-(2-methoxyethyl)phenyl]ethanol.
What is the SMILES notation for 2,2-difluoro-1-[4-(2-methoxyethyl)phenyl]ethanol?
The canonical SMILES for 2,2-difluoro-1-[4-(2-methoxyethyl)phenyl]ethanol is COCCc1ccc(C(O)C(F)F)cc1.
What is the InChIKey of 2,2-difluoro-1-[4-(2-methoxyethyl)phenyl]ethanol?
The InChIKey is JBHUKZRSZDGPSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F2O2/c1-15-7-6-8-2-4-9(5-3-8)10(14)11(12)13/h2-5,10-11,14H,6-7H2,1H3.
What are the key properties of 2,2-difluoro-1-[4-(2-methoxyethyl)phenyl]ethanol?
2,2-difluoro-1-[4-(2-methoxyethyl)phenyl]ethanol has a molecular weight of 216.23 g/mol, XLogP of 2.17, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-1-[4-(2-methoxyethyl)phenyl]ethanol is sourced from PubChem (CID 104632700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).