2-(2,3-dichlorophenyl)-1-(2-methoxy-4-methylphenyl)ethanol

C16H16Cl2O2 — CID 107308318

IUPAC2-(2,3-dichlorophenyl)-1-(2-methoxy-4-methylphenyl)ethanol
SMILESCOc1cc(C)ccc1C(O)Cc1cccc(Cl)c1Cl
InChIInChI=1S/C16H16Cl2O2/c1-10-6-7-12(15(8-10)20-2)14(19)9-11-4-3-5-13(17)16(11)18/h3-8,14,19H,9H2,1-2H3
InChIKeyVHWLZRCXZHIXCB-UHFFFAOYSA-N
MW311.21 g/mol
LogP4.59
Rot. Bonds4

About 2-(2,3-dichlorophenyl)-1-(2-methoxy-4-methylphenyl)ethanol

2-(2,3-dichlorophenyl)-1-(2-methoxy-4-methylphenyl)ethanol (PubChem CID 107308318) has the molecular formula C16H16Cl2O2 and a molecular weight of 311.21 g/mol. Its IUPAC name is 2-(2,3-dichlorophenyl)-1-(2-methoxy-4-methylphenyl)ethanol.

Molecular Properties

Compound Name2-(2,3-dichlorophenyl)-1-(2-methoxy-4-methylphenyl)ethanol
PubChem CID107308318
Molecular FormulaC16H16Cl2O2
Molecular Weight311.21 g/mol
Exact Mass310.05
IUPAC Name2-(2,3-dichlorophenyl)-1-(2-methoxy-4-methylphenyl)ethanol
SMILESCOc1cc(C)ccc1C(O)Cc1cccc(Cl)c1Cl
InChIInChI=1S/C16H16Cl2O2/c1-10-6-7-12(15(8-10)20-2)14(19)9-11-4-3-5-13(17)16(11)18/h3-8,14,19H,9H2,1-2H3
InChIKeyVHWLZRCXZHIXCB-UHFFFAOYSA-N
XLogP4.59
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.21
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-chloro-4-methylphenyl)-2-(2,3-dichlorophenyl)ethanol
CID 107312550
1-(2-bromo-4-methylphenyl)-2-(2,3-dichlorophenyl)ethanol
CID 107307604
1-(2-bromo-5-methylphenyl)-2-(2,3-dichlorophenyl)ethanol
CID 107312495
2-(2,5-dichlorophenyl)-1-(2-methoxy-4-methylphenyl)ethanol
CID 106790756
2-(2,6-dimethylphenyl)-1-(2-methoxy-4-methylphenyl)ethanol
CID 106791042
2-(2-bromophenyl)-1-(2-methoxy-4-methylphenyl)ethanol
CID 106790626
2-(5-chlorothiophen-2-yl)-1-(2-methoxy-4-methylphenyl)ethanol
CID 106790809
1-(4-bromo-2-methoxyphenyl)-2-(2-chloro-3-fluorophenyl)ethanol
CID 115831118
2-(2,3-dichlorophenyl)-1-(3-fluoro-4-methoxyphenyl)ethanol
CID 107307527
1-(4-chloro-2-methoxyphenyl)-2-(2,3-dichlorophenyl)ethanamine
CID 107309207
2-(5-chloro-2-methoxyphenyl)-1-(2,3-dichlorophenyl)ethanol
CID 65148612
2-(2-chloro-3-fluorophenyl)-1-(2-methoxy-4-methylphenyl)ethanamine
CID 106791439

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dichlorophenyl)-1-(2-methoxy-4-methylphenyl)ethanol?
The IUPAC name of 2-(2,3-dichlorophenyl)-1-(2-methoxy-4-methylphenyl)ethanol (CID 107308318) is 2-(2,3-dichlorophenyl)-1-(2-methoxy-4-methylphenyl)ethanol.
What is the SMILES notation for 2-(2,3-dichlorophenyl)-1-(2-methoxy-4-methylphenyl)ethanol?
The canonical SMILES for 2-(2,3-dichlorophenyl)-1-(2-methoxy-4-methylphenyl)ethanol is COc1cc(C)ccc1C(O)Cc1cccc(Cl)c1Cl.
What is the InChIKey of 2-(2,3-dichlorophenyl)-1-(2-methoxy-4-methylphenyl)ethanol?
The InChIKey is VHWLZRCXZHIXCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16Cl2O2/c1-10-6-7-12(15(8-10)20-2)14(19)9-11-4-3-5-13(17)16(11)18/h3-8,14,19H,9H2,1-2H3.
What are the key properties of 2-(2,3-dichlorophenyl)-1-(2-methoxy-4-methylphenyl)ethanol?
2-(2,3-dichlorophenyl)-1-(2-methoxy-4-methylphenyl)ethanol has a molecular weight of 311.21 g/mol, XLogP of 4.59, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dichlorophenyl)-1-(2-methoxy-4-methylphenyl)ethanol is sourced from PubChem (CID 107308318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).