2-(2,4-dichlorophenoxy)cyclohexan-1-ol

C12H14Cl2O2 — CID 60728407

IUPAC2-(2,4-dichlorophenoxy)cyclohexan-1-ol
SMILESOC1CCCCC1Oc1ccc(Cl)cc1Cl
InChIInChI=1S/C12H14Cl2O2/c13-8-5-6-11(9(14)7-8)16-12-4-2-1-3-10(12)15/h5-7,10,12,15H,1-4H2
InChIKeyZFUWBRWPZNUUTO-UHFFFAOYSA-N
MW261.15 g/mol
LogP3.68
Rot. Bonds2

About 2-(2,4-dichlorophenoxy)cyclohexan-1-ol

2-(2,4-dichlorophenoxy)cyclohexan-1-ol (PubChem CID 60728407) has the molecular formula C12H14Cl2O2 and a molecular weight of 261.15 g/mol. Its IUPAC name is 2-(2,4-dichlorophenoxy)cyclohexan-1-ol.

Molecular Properties

Compound Name2-(2,4-dichlorophenoxy)cyclohexan-1-ol
PubChem CID60728407
Molecular FormulaC12H14Cl2O2
Molecular Weight261.15 g/mol
Exact Mass260.04
IUPAC Name2-(2,4-dichlorophenoxy)cyclohexan-1-ol
SMILESOC1CCCCC1Oc1ccc(Cl)cc1Cl
InChIInChI=1S/C12H14Cl2O2/c13-8-5-6-11(9(14)7-8)16-12-4-2-1-3-10(12)15/h5-7,10,12,15H,1-4H2
InChIKeyZFUWBRWPZNUUTO-UHFFFAOYSA-N
XLogP3.68
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.15
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

trans-(1S,2S)-2-(4-bromo-2-chlorophenoxy)cyclohexan-1-ol
CID 102732484
2-(2,4,5-trichlorophenoxy)cyclohexan-1-ol
CID 60728681
trans-(1S,2S)-2-(2-bromo-4-chlorophenoxy)cyclopentan-1-ol
CID 102735425
5-chloro-2-(2-hydroxycyclohexyl)oxybenzaldehyde
CID 60884420
[2-(2,4-dichlorophenoxy)cyclohexyl]methanamine
CID 43531169
trans-(1S,2S)-2-(5-chloro-2-methylphenoxy)cyclopentan-1-ol
CID 102735536
2-(2-chloro-4-phenylphenoxy)cyclopentan-1-ol
CID 60877836
trans-(1S,2S)-2-(2-chloro-4-phenylphenoxy)cyclopentan-1-ol
CID 102735372
4-chloro-2-(2-hydroxycyclohexyl)oxybenzonitrile
CID 113277308
4-chloro-2-(2-hydroxycycloheptyl)oxybenzonitrile
CID 113277283
[2-(2,4-dichlorophenoxy)cyclopentyl]methanamine
CID 43531164
2-(3-chlorophenoxy)cyclohexan-1-ol
CID 60880666

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenoxy)cyclohexan-1-ol?
The IUPAC name of 2-(2,4-dichlorophenoxy)cyclohexan-1-ol (CID 60728407) is 2-(2,4-dichlorophenoxy)cyclohexan-1-ol.
What is the SMILES notation for 2-(2,4-dichlorophenoxy)cyclohexan-1-ol?
The canonical SMILES for 2-(2,4-dichlorophenoxy)cyclohexan-1-ol is OC1CCCCC1Oc1ccc(Cl)cc1Cl.
What is the InChIKey of 2-(2,4-dichlorophenoxy)cyclohexan-1-ol?
The InChIKey is ZFUWBRWPZNUUTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14Cl2O2/c13-8-5-6-11(9(14)7-8)16-12-4-2-1-3-10(12)15/h5-7,10,12,15H,1-4H2.
What are the key properties of 2-(2,4-dichlorophenoxy)cyclohexan-1-ol?
2-(2,4-dichlorophenoxy)cyclohexan-1-ol has a molecular weight of 261.15 g/mol, XLogP of 3.68, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenoxy)cyclohexan-1-ol is sourced from PubChem (CID 60728407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).