1-(2,6-dichlorophenyl)-2-(4-propan-2-ylphenyl)ethanol

C17H18Cl2O — CID 65150451

IUPAC1-(2,6-dichlorophenyl)-2-(4-propan-2-ylphenyl)ethanol
SMILESCC(C)c1ccc(CC(O)c2c(Cl)cccc2Cl)cc1
InChIInChI=1S/C17H18Cl2O/c1-11(2)13-8-6-12(7-9-13)10-16(20)17-14(18)4-3-5-15(17)19/h3-9,11,16,20H,10H2,1-2H3
InChIKeyIPCKAVJNDKWBLY-UHFFFAOYSA-N
MW309.24 g/mol
LogP5.39
Rot. Bonds4

About 1-(2,6-dichlorophenyl)-2-(4-propan-2-ylphenyl)ethanol

1-(2,6-dichlorophenyl)-2-(4-propan-2-ylphenyl)ethanol (PubChem CID 65150451) has the molecular formula C17H18Cl2O and a molecular weight of 309.24 g/mol. Its IUPAC name is 1-(2,6-dichlorophenyl)-2-(4-propan-2-ylphenyl)ethanol.

Molecular Properties

Compound Name1-(2,6-dichlorophenyl)-2-(4-propan-2-ylphenyl)ethanol
PubChem CID65150451
Molecular FormulaC17H18Cl2O
Molecular Weight309.24 g/mol
Exact Mass308.07
IUPAC Name1-(2,6-dichlorophenyl)-2-(4-propan-2-ylphenyl)ethanol
SMILESCC(C)c1ccc(CC(O)c2c(Cl)cccc2Cl)cc1
InChIInChI=1S/C17H18Cl2O/c1-11(2)13-8-6-12(7-9-13)10-16(20)17-14(18)4-3-5-15(17)19/h3-9,11,16,20H,10H2,1-2H3
InChIKeyIPCKAVJNDKWBLY-UHFFFAOYSA-N
XLogP5.39
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500309.24
LogP ≤ 55.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-(2,6-dichlorophenyl)-2-(4-propan-2-ylphenyl)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-(4-chlorophenyl)-1-(2,6-dichlorophenyl)ethanol
CID 63519306
1-(2,6-dichlorophenyl)-2-(4-methoxyphenyl)ethanol
CID 63018440
2-(4-chlorophenyl)-1-(4-propan-2-ylphenyl)ethanol
CID 60797871
1-(2-chloro-6-fluorophenyl)-2-(4-chlorophenyl)ethanol
CID 63016942
1-(4-aminophenyl)-2-(4-propan-2-ylphenyl)ethanol
CID 106695441
2-(3,4-dichlorophenyl)-1-(4-propan-2-ylphenyl)ethanol
CID 63410604
1-(3-chloro-4-fluorophenyl)-2-(4-propan-2-ylphenyl)ethanol
CID 63414664
1-(2,6-dichlorophenyl)-2-(2-methylphenyl)ethanol
CID 63016225
1-(4-propan-2-ylphenyl)pentane-2,3-diol
CID 103454563
2-(3-chloro-2-fluorophenyl)-1-[4-(2-methylpropyl)phenyl]ethanol
CID 102856962
1-chloro-2-[chloro-[4-(2-methylpropyl)phenyl]methyl]-3-fluorobenzene
CID 63431072
1-(3-chloro-4-pyridinyl)-2-(4-propan-2-ylphenyl)ethanol
CID 105089032

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dichlorophenyl)-2-(4-propan-2-ylphenyl)ethanol?
The IUPAC name of 1-(2,6-dichlorophenyl)-2-(4-propan-2-ylphenyl)ethanol (CID 65150451) is 1-(2,6-dichlorophenyl)-2-(4-propan-2-ylphenyl)ethanol.
What is the SMILES notation for 1-(2,6-dichlorophenyl)-2-(4-propan-2-ylphenyl)ethanol?
The canonical SMILES for 1-(2,6-dichlorophenyl)-2-(4-propan-2-ylphenyl)ethanol is CC(C)c1ccc(CC(O)c2c(Cl)cccc2Cl)cc1.
What is the InChIKey of 1-(2,6-dichlorophenyl)-2-(4-propan-2-ylphenyl)ethanol?
The InChIKey is IPCKAVJNDKWBLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18Cl2O/c1-11(2)13-8-6-12(7-9-13)10-16(20)17-14(18)4-3-5-15(17)19/h3-9,11,16,20H,10H2,1-2H3.
What are the key properties of 1-(2,6-dichlorophenyl)-2-(4-propan-2-ylphenyl)ethanol?
1-(2,6-dichlorophenyl)-2-(4-propan-2-ylphenyl)ethanol has a molecular weight of 309.24 g/mol, XLogP of 5.39, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dichlorophenyl)-2-(4-propan-2-ylphenyl)ethanol is sourced from PubChem (CID 65150451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).