2-(2,6-dichloro-4-methylphenoxy)ethanol

C9H10Cl2O2 — CID 21396902

IUPAC2-(2,6-dichloro-4-methylphenoxy)ethanol
SMILESCc1cc(Cl)c(OCCO)c(Cl)c1
InChIInChI=1S/C9H10Cl2O2/c1-6-4-7(10)9(8(11)5-6)13-3-2-12/h4-5,12H,2-3H2,1H3
InChIKeyLZHCEVNRXVOGCX-UHFFFAOYSA-N
MW221.08 g/mol
LogP2.67
Rot. Bonds3

About 2-(2,6-dichloro-4-methylphenoxy)ethanol

2-(2,6-dichloro-4-methylphenoxy)ethanol (PubChem CID 21396902) has the molecular formula C9H10Cl2O2 and a molecular weight of 221.08 g/mol. Its IUPAC name is 2-(2,6-dichloro-4-methylphenoxy)ethanol.

Molecular Properties

Compound Name2-(2,6-dichloro-4-methylphenoxy)ethanol
PubChem CID21396902
Molecular FormulaC9H10Cl2O2
Molecular Weight221.08 g/mol
Exact Mass220.01
IUPAC Name2-(2,6-dichloro-4-methylphenoxy)ethanol
SMILESCc1cc(Cl)c(OCCO)c(Cl)c1
InChIInChI=1S/C9H10Cl2O2/c1-6-4-7(10)9(8(11)5-6)13-3-2-12/h4-5,12H,2-3H2,1H3
InChIKeyLZHCEVNRXVOGCX-UHFFFAOYSA-N
XLogP2.67
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.08
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,3-dichloro-5-methyl-2-[2-(4-methylphenoxy)ethoxy]benzene
CID 58376578
1-(2,6-dichloro-4-methylphenoxy)propan-2-ol
CID 90679727
5-(2,4,6-trichlorophenoxy)pentan-1-ol
CID 62229545
2-(2-bromo-6-chloro-4-methylphenoxy)ethanamine
CID 84711241
2-(2-hydroxyethoxy)-3,5-dimethylbenzonitrile
CID 151560499
1-chloro-5-methyl-2-propoxy-3-(trifluoromethyl)benzene
CID 146247201
4-butoxy-3,5-dichlorophenol
CID 91234331
2-(3-methoxy-5-methylphenoxy)ethanol
CID 59177464
5-(2,4,6-trimethylphenoxy)pentan-1-ol
CID 62228821
2-(2,4,5-trichlorophenoxy)ethanol
CID 87745106
4-(2-chloro-4,6-dimethylphenoxy)butyl-diethylazanium
CID 2262334
2-[4-(2-hydroxyethoxy)-2,3-dimethylphenoxy]ethanol
CID 14025005

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dichloro-4-methylphenoxy)ethanol?
The IUPAC name of 2-(2,6-dichloro-4-methylphenoxy)ethanol (CID 21396902) is 2-(2,6-dichloro-4-methylphenoxy)ethanol.
What is the SMILES notation for 2-(2,6-dichloro-4-methylphenoxy)ethanol?
The canonical SMILES for 2-(2,6-dichloro-4-methylphenoxy)ethanol is Cc1cc(Cl)c(OCCO)c(Cl)c1.
What is the InChIKey of 2-(2,6-dichloro-4-methylphenoxy)ethanol?
The InChIKey is LZHCEVNRXVOGCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10Cl2O2/c1-6-4-7(10)9(8(11)5-6)13-3-2-12/h4-5,12H,2-3H2,1H3.
What are the key properties of 2-(2,6-dichloro-4-methylphenoxy)ethanol?
2-(2,6-dichloro-4-methylphenoxy)ethanol has a molecular weight of 221.08 g/mol, XLogP of 2.67, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dichloro-4-methylphenoxy)ethanol is sourced from PubChem (CID 21396902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).