2-[(2-fluoro-4,6-diphenylphenyl)methoxy]ethanol

C21H19FO2 — CID 140569414

IUPAC2-[(2-fluoro-4,6-diphenylphenyl)methoxy]ethanol
SMILESOCCOCc1c(F)cc(-c2ccccc2)cc1-c1ccccc1
InChIInChI=1S/C21H19FO2/c22-21-14-18(16-7-3-1-4-8-16)13-19(17-9-5-2-6-10-17)20(21)15-24-12-11-23/h1-10,13-14,23H,11-12,15H2
InChIKeyUGDGJUFKXHJZAY-UHFFFAOYSA-N
MW322.38 g/mol
LogP4.67
Rot. Bonds6

About 2-[(2-fluoro-4,6-diphenylphenyl)methoxy]ethanol

2-[(2-fluoro-4,6-diphenylphenyl)methoxy]ethanol (PubChem CID 140569414) has the molecular formula C21H19FO2 and a molecular weight of 322.38 g/mol. Its IUPAC name is 2-[(2-fluoro-4,6-diphenylphenyl)methoxy]ethanol.

Molecular Properties

Compound Name2-[(2-fluoro-4,6-diphenylphenyl)methoxy]ethanol
PubChem CID140569414
Molecular FormulaC21H19FO2
Molecular Weight322.38 g/mol
Exact Mass322.14
IUPAC Name2-[(2-fluoro-4,6-diphenylphenyl)methoxy]ethanol
SMILESOCCOCc1c(F)cc(-c2ccccc2)cc1-c1ccccc1
InChIInChI=1S/C21H19FO2/c22-21-14-18(16-7-3-1-4-8-16)13-19(17-9-5-2-6-10-17)20(21)15-24-12-11-23/h1-10,13-14,23H,11-12,15H2
InChIKeyUGDGJUFKXHJZAY-UHFFFAOYSA-N
XLogP4.67
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.38
LogP ≤ 54.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-[(2-methoxy-4,6-diphenylphenyl)methoxy]propan-1-amine
CID 140569407
2-chloro-1-fluoro-3,5-diphenylbenzene
CID 23135570
2-fluoro-1,3,5-triphenylbenzene
CID 146653815
2-chloro-1,3-difluoro-5-(2,4,6-triphenylphenyl)benzene
CID 176875613
2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethanol;4-phenylbenzaldehyde
CID 175290890
(2-ethyl-3,5-diphenylphenyl)methanol
CID 172831551
2-(2-methoxyethoxy)ethanol;2-phenylmethoxyethanol
CID 138692115
2-[4-(2-fluorophenyl)phenyl]propanoic acid;2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethanol
CID 67714833
4-fluoro-3-(2-hydroxyethoxymethyl)benzoic acid
CID 63072945
5-(3,5-diphenylphenyl)-2-methyl-1,3-diphenylbenzene
CID 58760870
[2-[2-[2-[2-[2,6-bis(hydroxymethyl)-4-phenylphenoxy]ethoxy]ethoxy]ethoxy]-3-(hydroxymethyl)-5-phenylphenyl]methanol
CID 71560113
1,3-difluoro-2-methoxy-5-phenylbenzene
CID 164892027

Frequently Asked Questions

What is the IUPAC name of 2-[(2-fluoro-4,6-diphenylphenyl)methoxy]ethanol?
The IUPAC name of 2-[(2-fluoro-4,6-diphenylphenyl)methoxy]ethanol (CID 140569414) is 2-[(2-fluoro-4,6-diphenylphenyl)methoxy]ethanol.
What is the SMILES notation for 2-[(2-fluoro-4,6-diphenylphenyl)methoxy]ethanol?
The canonical SMILES for 2-[(2-fluoro-4,6-diphenylphenyl)methoxy]ethanol is OCCOCc1c(F)cc(-c2ccccc2)cc1-c1ccccc1.
What is the InChIKey of 2-[(2-fluoro-4,6-diphenylphenyl)methoxy]ethanol?
The InChIKey is UGDGJUFKXHJZAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19FO2/c22-21-14-18(16-7-3-1-4-8-16)13-19(17-9-5-2-6-10-17)20(21)15-24-12-11-23/h1-10,13-14,23H,11-12,15H2.
What are the key properties of 2-[(2-fluoro-4,6-diphenylphenyl)methoxy]ethanol?
2-[(2-fluoro-4,6-diphenylphenyl)methoxy]ethanol has a molecular weight of 322.38 g/mol, XLogP of 4.67, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-fluoro-4,6-diphenylphenyl)methoxy]ethanol is sourced from PubChem (CID 140569414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).