2-(2,5-dichlorophenyl)-1-(3,5-dichlorophenyl)ethanol

C14H10Cl4O — CID 65316811

IUPAC2-(2,5-dichlorophenyl)-1-(3,5-dichlorophenyl)ethanol
SMILESOC(Cc1cc(Cl)ccc1Cl)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C14H10Cl4O/c15-10-1-2-13(18)8(3-10)6-14(19)9-4-11(16)7-12(17)5-9/h1-5,7,14,19H,6H2
InChIKeySTAARGBQTICTTJ-UHFFFAOYSA-N
MW336.05 g/mol
LogP5.58
Rot. Bonds3

About 2-(2,5-dichlorophenyl)-1-(3,5-dichlorophenyl)ethanol

2-(2,5-dichlorophenyl)-1-(3,5-dichlorophenyl)ethanol (PubChem CID 65316811) has the molecular formula C14H10Cl4O and a molecular weight of 336.05 g/mol. Its IUPAC name is 2-(2,5-dichlorophenyl)-1-(3,5-dichlorophenyl)ethanol.

Molecular Properties

Compound Name2-(2,5-dichlorophenyl)-1-(3,5-dichlorophenyl)ethanol
PubChem CID65316811
Molecular FormulaC14H10Cl4O
Molecular Weight336.05 g/mol
Exact Mass333.95
IUPAC Name2-(2,5-dichlorophenyl)-1-(3,5-dichlorophenyl)ethanol
SMILESOC(Cc1cc(Cl)ccc1Cl)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C14H10Cl4O/c15-10-1-2-13(18)8(3-10)6-14(19)9-4-11(16)7-12(17)5-9/h1-5,7,14,19H,6H2
InChIKeySTAARGBQTICTTJ-UHFFFAOYSA-N
XLogP5.58
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.05
LogP ≤ 55.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(4-chlorophenyl)-2-(2,5-dichlorophenyl)ethanol
CID 65316618
2-(2,5-dichlorophenyl)-1-(4-iodophenyl)ethanol
CID 115802046
2-(2,5-dichlorophenyl)-1-(4-methylphenyl)ethanol
CID 65316953
1-(3-bromo-4-chlorophenyl)-2-(2,5-dichlorophenyl)ethanol
CID 115566546
[2-(2,5-dichlorophenyl)-1-(3,5-dichlorophenyl)ethyl]hydrazine
CID 105309863
2-(2,5-dichlorophenyl)-1-pyridazin-4-ylethanol
CID 105100348
2-(2,5-dichlorophenyl)-1-naphthalen-2-ylethanol
CID 65317190
2-(4-chlorophenyl)-1-(3,5-dichlorophenyl)ethanol
CID 63519476
2-(2,5-dichlorophenyl)-1-[3-(trifluoromethyl)phenyl]ethanol
CID 65317239
1-(4-bromo-2-methylphenyl)-2-(2,5-dichlorophenyl)ethanol
CID 115801912
2-(2,5-dichlorophenyl)-1-(3,5-dichlorophenyl)-N-ethylethanamine
CID 115863164
1-(4,5-dibromofuran-2-yl)-2-(2,5-dichlorophenyl)ethanol
CID 65317285

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dichlorophenyl)-1-(3,5-dichlorophenyl)ethanol?
The IUPAC name of 2-(2,5-dichlorophenyl)-1-(3,5-dichlorophenyl)ethanol (CID 65316811) is 2-(2,5-dichlorophenyl)-1-(3,5-dichlorophenyl)ethanol.
What is the SMILES notation for 2-(2,5-dichlorophenyl)-1-(3,5-dichlorophenyl)ethanol?
The canonical SMILES for 2-(2,5-dichlorophenyl)-1-(3,5-dichlorophenyl)ethanol is OC(Cc1cc(Cl)ccc1Cl)c1cc(Cl)cc(Cl)c1.
What is the InChIKey of 2-(2,5-dichlorophenyl)-1-(3,5-dichlorophenyl)ethanol?
The InChIKey is STAARGBQTICTTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl4O/c15-10-1-2-13(18)8(3-10)6-14(19)9-4-11(16)7-12(17)5-9/h1-5,7,14,19H,6H2.
What are the key properties of 2-(2,5-dichlorophenyl)-1-(3,5-dichlorophenyl)ethanol?
2-(2,5-dichlorophenyl)-1-(3,5-dichlorophenyl)ethanol has a molecular weight of 336.05 g/mol, XLogP of 5.58, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dichlorophenyl)-1-(3,5-dichlorophenyl)ethanol is sourced from PubChem (CID 65316811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).