2,4-dichloro-3-[2-(4-methoxyphenyl)ethyl]phenol

C15H14Cl2O2 — CID 24762917

IUPAC2,4-dichloro-3-[2-(4-methoxyphenyl)ethyl]phenol
SMILESCOc1ccc(CCc2c(Cl)ccc(O)c2Cl)cc1
InChIInChI=1S/C15H14Cl2O2/c1-19-11-5-2-10(3-6-11)4-7-12-13(16)8-9-14(18)15(12)17/h2-3,5-6,8-9,18H,4,7H2,1H3
InChIKeyQSWIRQVPUSIUGY-UHFFFAOYSA-N
MW297.18 g/mol
LogP4.49
Rot. Bonds4

About 2,4-dichloro-3-[2-(4-methoxyphenyl)ethyl]phenol

2,4-dichloro-3-[2-(4-methoxyphenyl)ethyl]phenol (PubChem CID 24762917) has the molecular formula C15H14Cl2O2 and a molecular weight of 297.18 g/mol. Its IUPAC name is 2,4-dichloro-3-[2-(4-methoxyphenyl)ethyl]phenol.

Molecular Properties

Compound Name2,4-dichloro-3-[2-(4-methoxyphenyl)ethyl]phenol
PubChem CID24762917
Molecular FormulaC15H14Cl2O2
Molecular Weight297.18 g/mol
Exact Mass296.04
IUPAC Name2,4-dichloro-3-[2-(4-methoxyphenyl)ethyl]phenol
SMILESCOc1ccc(CCc2c(Cl)ccc(O)c2Cl)cc1
InChIInChI=1S/C15H14Cl2O2/c1-19-11-5-2-10(3-6-11)4-7-12-13(16)8-9-14(18)15(12)17/h2-3,5-6,8-9,18H,4,7H2,1H3
InChIKeyQSWIRQVPUSIUGY-UHFFFAOYSA-N
XLogP4.49
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.18
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2,4-dichloro-3-[2-(4-methoxyphenyl)ethyl]phenol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-3-[2-(4-methoxyphenyl)ethyl]phenol?
The IUPAC name of 2,4-dichloro-3-[2-(4-methoxyphenyl)ethyl]phenol (CID 24762917) is 2,4-dichloro-3-[2-(4-methoxyphenyl)ethyl]phenol.
What is the SMILES notation for 2,4-dichloro-3-[2-(4-methoxyphenyl)ethyl]phenol?
The canonical SMILES for 2,4-dichloro-3-[2-(4-methoxyphenyl)ethyl]phenol is COc1ccc(CCc2c(Cl)ccc(O)c2Cl)cc1.
What is the InChIKey of 2,4-dichloro-3-[2-(4-methoxyphenyl)ethyl]phenol?
The InChIKey is QSWIRQVPUSIUGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Cl2O2/c1-19-11-5-2-10(3-6-11)4-7-12-13(16)8-9-14(18)15(12)17/h2-3,5-6,8-9,18H,4,7H2,1H3.
What are the key properties of 2,4-dichloro-3-[2-(4-methoxyphenyl)ethyl]phenol?
2,4-dichloro-3-[2-(4-methoxyphenyl)ethyl]phenol has a molecular weight of 297.18 g/mol, XLogP of 4.49, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-3-[2-(4-methoxyphenyl)ethyl]phenol is sourced from PubChem (CID 24762917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).