2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanol

C15H12Cl4O2 — CID 70556653

IUPAC2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanol
SMILESOCC(OCc1ccc(Cl)cc1Cl)c1ccc(Cl)cc1Cl
InChIInChI=1S/C15H12Cl4O2/c16-10-2-1-9(13(18)5-10)8-21-15(7-20)12-4-3-11(17)6-14(12)19/h1-6,15,20H,7-8H2
InChIKeySTCKGTFOQRQLEA-UHFFFAOYSA-N
MW366.07 g/mol
LogP5.55
Rot. Bonds5

About 2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanol

2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanol (PubChem CID 70556653) has the molecular formula C15H12Cl4O2 and a molecular weight of 366.07 g/mol. Its IUPAC name is 2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanol.

Molecular Properties

Compound Name2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanol
PubChem CID70556653
Molecular FormulaC15H12Cl4O2
Molecular Weight366.07 g/mol
Exact Mass363.96
IUPAC Name2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanol
SMILESOCC(OCc1ccc(Cl)cc1Cl)c1ccc(Cl)cc1Cl
InChIInChI=1S/C15H12Cl4O2/c16-10-2-1-9(13(18)5-10)8-21-15(7-20)12-4-3-11(17)6-14(12)19/h1-6,15,20H,7-8H2
InChIKeySTCKGTFOQRQLEA-UHFFFAOYSA-N
XLogP5.55
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.07
LogP ≤ 55.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanamine
CID 156596799
2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanamine;hydrochloride
CID 175674542
N-[2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethyl]formamide
CID 15111116
2,4-dichloro-1-[1-[(4-chloro-2-methylphenyl)methoxy]propyl]benzene
CID 143164368
1-[2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethyl]imidazole;rhodium
CID 142358126
tris(1-[2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethyl]imidazole);bis(nitric acid)
CID 173294934
1-[bis(4-chlorophenyl)methyl]-3-[2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethyl]imidazolidine
CID 161434696
1-[bis(4-chlorophenyl)methyl]-3-[2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethyl]-2H-imidazole;hydrochloride
CID 91982160
1-[2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethyl]-3-ethylimidazol-1-ium;chloride;dihydrochloride
CID 161296312
(2R)-2-(2,4-dichlorophenyl)-2-iodoethanol
CID 70228601
1-[2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethyl]-3-(2-phenylethyl)-1,2-dihydroimidazol-1-ium chloride
CID 23624134
(1R)-1-[4-[(2,4-dichlorophenyl)methoxy]-2-fluorophenyl]ethanol
CID 107720070

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanol?
The IUPAC name of 2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanol (CID 70556653) is 2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanol.
What is the SMILES notation for 2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanol?
The canonical SMILES for 2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanol is OCC(OCc1ccc(Cl)cc1Cl)c1ccc(Cl)cc1Cl.
What is the InChIKey of 2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanol?
The InChIKey is STCKGTFOQRQLEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl4O2/c16-10-2-1-9(13(18)5-10)8-21-15(7-20)12-4-3-11(17)6-14(12)19/h1-6,15,20H,7-8H2.
What are the key properties of 2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanol?
2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanol has a molecular weight of 366.07 g/mol, XLogP of 5.55, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanol is sourced from PubChem (CID 70556653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).