1-(2-chloro-6-fluorophenyl)-2-(4-chloro-2-fluorophenyl)ethanol

C14H10Cl2F2O — CID 114851983

IUPAC1-(2-chloro-6-fluorophenyl)-2-(4-chloro-2-fluorophenyl)ethanol
SMILESOC(Cc1ccc(Cl)cc1F)c1c(F)cccc1Cl
InChIInChI=1S/C14H10Cl2F2O/c15-9-5-4-8(12(18)7-9)6-13(19)14-10(16)2-1-3-11(14)17/h1-5,7,13,19H,6H2
InChIKeySJISKDGCKFFXKR-UHFFFAOYSA-N
MW303.14 g/mol
LogP4.55
Rot. Bonds3

About 1-(2-chloro-6-fluorophenyl)-2-(4-chloro-2-fluorophenyl)ethanol

1-(2-chloro-6-fluorophenyl)-2-(4-chloro-2-fluorophenyl)ethanol (PubChem CID 114851983) has the molecular formula C14H10Cl2F2O and a molecular weight of 303.14 g/mol. Its IUPAC name is 1-(2-chloro-6-fluorophenyl)-2-(4-chloro-2-fluorophenyl)ethanol.

Molecular Properties

Compound Name1-(2-chloro-6-fluorophenyl)-2-(4-chloro-2-fluorophenyl)ethanol
PubChem CID114851983
Molecular FormulaC14H10Cl2F2O
Molecular Weight303.14 g/mol
Exact Mass302.01
IUPAC Name1-(2-chloro-6-fluorophenyl)-2-(4-chloro-2-fluorophenyl)ethanol
SMILESOC(Cc1ccc(Cl)cc1F)c1c(F)cccc1Cl
InChIInChI=1S/C14H10Cl2F2O/c15-9-5-4-8(12(18)7-9)6-13(19)14-10(16)2-1-3-11(14)17/h1-5,7,13,19H,6H2
InChIKeySJISKDGCKFFXKR-UHFFFAOYSA-N
XLogP4.55
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.14
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-chloro-6-fluorophenyl)-2-(4-chlorophenyl)ethanol
CID 63016942
1-(2-chloro-6-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethanol
CID 63896005
2-(4-chloro-2-fluorophenyl)-1-(2,5-dichlorophenyl)ethanol
CID 115839677
2-(3-chloro-2-fluorophenyl)-1-(2,6-difluorophenyl)ethanol
CID 82802615
1-(2-bromo-6-fluorophenyl)-2-(5-chloro-2-fluorophenyl)ethanol
CID 103048373
2-(4-chloro-2-fluorophenyl)-1-(2,6-dichlorophenyl)-N-ethylethanamine
CID 105055242
2-(4-chloro-2-fluorophenyl)-1-(2-chloro-3-methylphenyl)ethanol
CID 115839825
2-(1-benzothiophen-3-yl)-1-(2-chloro-6-fluorophenyl)ethanol
CID 65151095
2-(2-chloro-3-fluorophenyl)-1-(2,6-difluorophenyl)ethanol
CID 112653011
2-(4-chloro-2-fluorophenyl)-1-(2,5-difluorophenyl)ethanol
CID 114852109
2-(4-chloro-2-fluorophenyl)-1-[3-(trifluoromethyl)phenyl]ethanol
CID 114852064
1-(2,5-dichlorophenyl)-2-(2-fluorophenyl)ethanol
CID 61082200

Frequently Asked Questions

What is the IUPAC name of 1-(2-chloro-6-fluorophenyl)-2-(4-chloro-2-fluorophenyl)ethanol?
The IUPAC name of 1-(2-chloro-6-fluorophenyl)-2-(4-chloro-2-fluorophenyl)ethanol (CID 114851983) is 1-(2-chloro-6-fluorophenyl)-2-(4-chloro-2-fluorophenyl)ethanol.
What is the SMILES notation for 1-(2-chloro-6-fluorophenyl)-2-(4-chloro-2-fluorophenyl)ethanol?
The canonical SMILES for 1-(2-chloro-6-fluorophenyl)-2-(4-chloro-2-fluorophenyl)ethanol is OC(Cc1ccc(Cl)cc1F)c1c(F)cccc1Cl.
What is the InChIKey of 1-(2-chloro-6-fluorophenyl)-2-(4-chloro-2-fluorophenyl)ethanol?
The InChIKey is SJISKDGCKFFXKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl2F2O/c15-9-5-4-8(12(18)7-9)6-13(19)14-10(16)2-1-3-11(14)17/h1-5,7,13,19H,6H2.
What are the key properties of 1-(2-chloro-6-fluorophenyl)-2-(4-chloro-2-fluorophenyl)ethanol?
1-(2-chloro-6-fluorophenyl)-2-(4-chloro-2-fluorophenyl)ethanol has a molecular weight of 303.14 g/mol, XLogP of 4.55, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chloro-6-fluorophenyl)-2-(4-chloro-2-fluorophenyl)ethanol is sourced from PubChem (CID 114851983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).