2-(2,4-dichlorophenyl)-1-[4-(difluoromethoxy)phenyl]ethanol

C15H12Cl2F2O2 — CID 65146137

IUPAC2-(2,4-dichlorophenyl)-1-[4-(difluoromethoxy)phenyl]ethanol
SMILESOC(Cc1ccc(Cl)cc1Cl)c1ccc(OC(F)F)cc1
InChIInChI=1S/C15H12Cl2F2O2/c16-11-4-1-10(13(17)8-11)7-14(20)9-2-5-12(6-3-9)21-15(18)19/h1-6,8,14-15,20H,7H2
InChIKeyHVROBVOZNIJGCJ-UHFFFAOYSA-N
MW333.16 g/mol
LogP4.87
Rot. Bonds5

About 2-(2,4-dichlorophenyl)-1-[4-(difluoromethoxy)phenyl]ethanol

2-(2,4-dichlorophenyl)-1-[4-(difluoromethoxy)phenyl]ethanol (PubChem CID 65146137) has the molecular formula C15H12Cl2F2O2 and a molecular weight of 333.16 g/mol. Its IUPAC name is 2-(2,4-dichlorophenyl)-1-[4-(difluoromethoxy)phenyl]ethanol.

Molecular Properties

Compound Name2-(2,4-dichlorophenyl)-1-[4-(difluoromethoxy)phenyl]ethanol
PubChem CID65146137
Molecular FormulaC15H12Cl2F2O2
Molecular Weight333.16 g/mol
Exact Mass332.02
IUPAC Name2-(2,4-dichlorophenyl)-1-[4-(difluoromethoxy)phenyl]ethanol
SMILESOC(Cc1ccc(Cl)cc1Cl)c1ccc(OC(F)F)cc1
InChIInChI=1S/C15H12Cl2F2O2/c16-11-4-1-10(13(17)8-11)7-14(20)9-2-5-12(6-3-9)21-15(18)19/h1-6,8,14-15,20H,7H2
InChIKeyHVROBVOZNIJGCJ-UHFFFAOYSA-N
XLogP4.87
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.16
LogP ≤ 54.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,4-dichlorophenyl)-1-(4-propan-2-yloxyphenyl)ethanol
CID 63410917
1-[4-(difluoromethoxy)phenyl]-2-(2,5-difluorophenyl)ethanol
CID 63893268
2-(2,4-dichlorophenyl)-1-(3-fluoro-4-methoxyphenyl)ethanol
CID 62796974
2-(5-chloro-2-fluorophenyl)-1-[3-(difluoromethoxy)phenyl]ethanol
CID 103053453
2-(2,4-dichlorophenyl)-1-[3-(difluoromethoxy)phenyl]ethanamine
CID 115840311
4-chloro-2-[[2-[4-(difluoromethoxy)phenyl]-2-hydroxyethyl]iminomethyl]phenol
CID 136819089
1-(4-chlorophenyl)-2-(2,5-dichlorophenyl)ethanol
CID 65316618
2-(5-chloro-2-fluorophenyl)-1-[4-(difluoromethoxy)phenyl]ethanamine
CID 103053140
2-(2,4-dichlorophenyl)-1-(3-fluoro-5-methylphenyl)ethanol
CID 79704311
1-(3-aminophenyl)-2-(2,4-dichlorophenyl)ethanol
CID 106695721
1,3-bis(2,4-dichlorophenyl)propan-2-ol
CID 63410533
1-[4-(difluoromethoxy)phenyl]-2-(4-methylphenyl)ethanol
CID 63017905

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenyl)-1-[4-(difluoromethoxy)phenyl]ethanol?
The IUPAC name of 2-(2,4-dichlorophenyl)-1-[4-(difluoromethoxy)phenyl]ethanol (CID 65146137) is 2-(2,4-dichlorophenyl)-1-[4-(difluoromethoxy)phenyl]ethanol.
What is the SMILES notation for 2-(2,4-dichlorophenyl)-1-[4-(difluoromethoxy)phenyl]ethanol?
The canonical SMILES for 2-(2,4-dichlorophenyl)-1-[4-(difluoromethoxy)phenyl]ethanol is OC(Cc1ccc(Cl)cc1Cl)c1ccc(OC(F)F)cc1.
What is the InChIKey of 2-(2,4-dichlorophenyl)-1-[4-(difluoromethoxy)phenyl]ethanol?
The InChIKey is HVROBVOZNIJGCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl2F2O2/c16-11-4-1-10(13(17)8-11)7-14(20)9-2-5-12(6-3-9)21-15(18)19/h1-6,8,14-15,20H,7H2.
What are the key properties of 2-(2,4-dichlorophenyl)-1-[4-(difluoromethoxy)phenyl]ethanol?
2-(2,4-dichlorophenyl)-1-[4-(difluoromethoxy)phenyl]ethanol has a molecular weight of 333.16 g/mol, XLogP of 4.87, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenyl)-1-[4-(difluoromethoxy)phenyl]ethanol is sourced from PubChem (CID 65146137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).