2-(3-chlorophenoxy)-1-(3-chlorophenyl)ethanol

C14H12Cl2O2 — CID 115766354

IUPAC2-(3-chlorophenoxy)-1-(3-chlorophenyl)ethanol
SMILESOC(COc1cccc(Cl)c1)c1cccc(Cl)c1
InChIInChI=1S/C14H12Cl2O2/c15-11-4-1-3-10(7-11)14(17)9-18-13-6-2-5-12(16)8-13/h1-8,14,17H,9H2
InChIKeyDGESMBUMNWZNQC-UHFFFAOYSA-N
MW283.15 g/mol
LogP4.11
Rot. Bonds4

About 2-(3-chlorophenoxy)-1-(3-chlorophenyl)ethanol

2-(3-chlorophenoxy)-1-(3-chlorophenyl)ethanol (PubChem CID 115766354) has the molecular formula C14H12Cl2O2 and a molecular weight of 283.15 g/mol. Its IUPAC name is 2-(3-chlorophenoxy)-1-(3-chlorophenyl)ethanol.

Molecular Properties

Compound Name2-(3-chlorophenoxy)-1-(3-chlorophenyl)ethanol
PubChem CID115766354
Molecular FormulaC14H12Cl2O2
Molecular Weight283.15 g/mol
Exact Mass282.02
IUPAC Name2-(3-chlorophenoxy)-1-(3-chlorophenyl)ethanol
SMILESOC(COc1cccc(Cl)c1)c1cccc(Cl)c1
InChIInChI=1S/C14H12Cl2O2/c15-11-4-1-3-10(7-11)14(17)9-18-13-6-2-5-12(16)8-13/h1-8,14,17H,9H2
InChIKeyDGESMBUMNWZNQC-UHFFFAOYSA-N
XLogP4.11
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.15
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(3-chlorophenoxy)-1-(3-chlorophenyl)ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(3-chlorophenoxy)-1-(3-ethoxyphenyl)ethanol
CID 105119515
4-[2-(3-chlorophenoxy)-1-hydroxyethyl]phenol
CID 117244629
1-(3-chlorophenyl)-2-(3-pyrimidin-2-yloxyphenoxy)ethanol
CID 109416427
2-(3-chlorophenoxy)-1-(3,5-dimethylphenyl)ethanol
CID 105079210
2-(3-chlorophenoxy)-1-(4-propan-2-yloxyphenyl)ethanol
CID 105095527
2-(3-chlorophenoxy)-1-(2-methylphenyl)ethanol
CID 115766345
2-(3-chlorophenoxy)-1-thiophen-2-ylethanol
CID 115766337
2-(3-chlorophenoxy)-1-(5-ethoxy-3-pyridinyl)ethanol
CID 105121340
3-(3-chlorophenoxy)-2-methylpropan-1-ol
CID 82076436
2-(3-chlorophenoxy)-1-(2,6-difluoro-3-methylphenyl)ethanol
CID 105121642
3-(3-chlorophenoxy)-2-(3-fluorophenyl)propan-1-ol
CID 117243052
(1R)-2-chloro-1-(3-chlorophenyl)ethanol
CID 10375278

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenoxy)-1-(3-chlorophenyl)ethanol?
The IUPAC name of 2-(3-chlorophenoxy)-1-(3-chlorophenyl)ethanol (CID 115766354) is 2-(3-chlorophenoxy)-1-(3-chlorophenyl)ethanol.
What is the SMILES notation for 2-(3-chlorophenoxy)-1-(3-chlorophenyl)ethanol?
The canonical SMILES for 2-(3-chlorophenoxy)-1-(3-chlorophenyl)ethanol is OC(COc1cccc(Cl)c1)c1cccc(Cl)c1.
What is the InChIKey of 2-(3-chlorophenoxy)-1-(3-chlorophenyl)ethanol?
The InChIKey is DGESMBUMNWZNQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2O2/c15-11-4-1-3-10(7-11)14(17)9-18-13-6-2-5-12(16)8-13/h1-8,14,17H,9H2.
What are the key properties of 2-(3-chlorophenoxy)-1-(3-chlorophenyl)ethanol?
2-(3-chlorophenoxy)-1-(3-chlorophenyl)ethanol has a molecular weight of 283.15 g/mol, XLogP of 4.11, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenoxy)-1-(3-chlorophenyl)ethanol is sourced from PubChem (CID 115766354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).