2-(2,3-difluorophenyl)-1-(2-propan-2-yloxyphenyl)ethanol

C17H18F2O2 — CID 115823684

IUPAC2-(2,3-difluorophenyl)-1-(2-propan-2-yloxyphenyl)ethanol
SMILESCC(C)Oc1ccccc1C(O)Cc1cccc(F)c1F
InChIInChI=1S/C17H18F2O2/c1-11(2)21-16-9-4-3-7-13(16)15(20)10-12-6-5-8-14(18)17(12)19/h3-9,11,15,20H,10H2,1-2H3
InChIKeyUWJCOBIFVGQAQJ-UHFFFAOYSA-N
MW292.33 g/mol
LogP4.03
Rot. Bonds5

About 2-(2,3-difluorophenyl)-1-(2-propan-2-yloxyphenyl)ethanol

2-(2,3-difluorophenyl)-1-(2-propan-2-yloxyphenyl)ethanol (PubChem CID 115823684) has the molecular formula C17H18F2O2 and a molecular weight of 292.33 g/mol. Its IUPAC name is 2-(2,3-difluorophenyl)-1-(2-propan-2-yloxyphenyl)ethanol.

Molecular Properties

Compound Name2-(2,3-difluorophenyl)-1-(2-propan-2-yloxyphenyl)ethanol
PubChem CID115823684
Molecular FormulaC17H18F2O2
Molecular Weight292.33 g/mol
Exact Mass292.13
IUPAC Name2-(2,3-difluorophenyl)-1-(2-propan-2-yloxyphenyl)ethanol
SMILESCC(C)Oc1ccccc1C(O)Cc1cccc(F)c1F
InChIInChI=1S/C17H18F2O2/c1-11(2)21-16-9-4-3-7-13(16)15(20)10-12-6-5-8-14(18)17(12)19/h3-9,11,15,20H,10H2,1-2H3
InChIKeyUWJCOBIFVGQAQJ-UHFFFAOYSA-N
XLogP4.03
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.33
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-bromo-3-methylphenyl)-2-(2,3-difluorophenyl)ethanol
CID 107983842
1-(2-bromo-3-fluorophenyl)-2-(2-fluoro-3-methoxyphenyl)ethanol
CID 115832698
2-(2-fluoro-3-methoxyphenyl)-1-(2,3,4-trifluorophenyl)ethanol
CID 115832717
2-(3-chloro-2-fluorophenyl)-1-(2-fluorophenyl)ethanol
CID 82802842
1,3-bis(2,3-difluorophenyl)propan-2-ol
CID 115788900
2-(2,3-difluorophenyl)-1-(2,6-dimethyl-3-pyridinyl)ethanol
CID 105089661
1-(2,6-dimethoxyphenyl)-2-(2-fluorophenyl)ethanol
CID 63018085
2-(propan-2-ylamino)-1-(2-propan-2-yloxyphenyl)ethanol
CID 79023945
1-(2,3-difluorophenyl)-3-(2-fluorophenyl)propan-2-ol
CID 55095617
2-(2,3-difluorophenoxy)-1-(2-methoxyphenyl)ethanol
CID 63038192
1-(2-chloro-4-methylphenyl)-2-(2,3-difluorophenyl)ethanol
CID 106859159
1-(1-benzothiophen-3-yl)-2-(2,3-difluorophenyl)ethanol
CID 65148709

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-difluorophenyl)-1-(2-propan-2-yloxyphenyl)ethanol?
The IUPAC name of 2-(2,3-difluorophenyl)-1-(2-propan-2-yloxyphenyl)ethanol (CID 115823684) is 2-(2,3-difluorophenyl)-1-(2-propan-2-yloxyphenyl)ethanol.
What is the SMILES notation for 2-(2,3-difluorophenyl)-1-(2-propan-2-yloxyphenyl)ethanol?
The canonical SMILES for 2-(2,3-difluorophenyl)-1-(2-propan-2-yloxyphenyl)ethanol is CC(C)Oc1ccccc1C(O)Cc1cccc(F)c1F.
What is the InChIKey of 2-(2,3-difluorophenyl)-1-(2-propan-2-yloxyphenyl)ethanol?
The InChIKey is UWJCOBIFVGQAQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18F2O2/c1-11(2)21-16-9-4-3-7-13(16)15(20)10-12-6-5-8-14(18)17(12)19/h3-9,11,15,20H,10H2,1-2H3.
What are the key properties of 2-(2,3-difluorophenyl)-1-(2-propan-2-yloxyphenyl)ethanol?
2-(2,3-difluorophenyl)-1-(2-propan-2-yloxyphenyl)ethanol has a molecular weight of 292.33 g/mol, XLogP of 4.03, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-difluorophenyl)-1-(2-propan-2-yloxyphenyl)ethanol is sourced from PubChem (CID 115823684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).