2-(2-chlorophenoxy)-4-methoxyphenol

C13H11ClO3 — CID 57036661

IUPAC2-(2-chlorophenoxy)-4-methoxyphenol
SMILESCOc1ccc(O)c(Oc2ccccc2Cl)c1
InChIInChI=1S/C13H11ClO3/c1-16-9-6-7-11(15)13(8-9)17-12-5-3-2-4-10(12)14/h2-8,15H,1H3
InChIKeyLKFCHIBKIZQOAF-UHFFFAOYSA-N
MW250.68 g/mol
LogP3.85
Rot. Bonds3

About 2-(2-chlorophenoxy)-4-methoxyphenol

2-(2-chlorophenoxy)-4-methoxyphenol (PubChem CID 57036661) has the molecular formula C13H11ClO3 and a molecular weight of 250.68 g/mol. Its IUPAC name is 2-(2-chlorophenoxy)-4-methoxyphenol.

Molecular Properties

Compound Name2-(2-chlorophenoxy)-4-methoxyphenol
PubChem CID57036661
Molecular FormulaC13H11ClO3
Molecular Weight250.68 g/mol
Exact Mass250.04
IUPAC Name2-(2-chlorophenoxy)-4-methoxyphenol
SMILESCOc1ccc(O)c(Oc2ccccc2Cl)c1
InChIInChI=1S/C13H11ClO3/c1-16-9-6-7-11(15)13(8-9)17-12-5-3-2-4-10(12)14/h2-8,15H,1H3
InChIKeyLKFCHIBKIZQOAF-UHFFFAOYSA-N
XLogP3.85
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.68
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-methoxyphenoxy)phenol
CID 54145402
(2-chlorophenyl) 2,4-dimethoxybenzoate
CID 2366254
1,4-dimethoxy-2-(2-methylphenoxy)benzene
CID 173173641
1-chloro-2-methoxybenzene
CID 13011
2-chloro-6-(2-chlorophenoxy)phenol
CID 101247244
methyl 2-[2-(2-chlorophenoxy)ethoxy]-4-methoxybenzoate
CID 78766506
2-[[(2-chlorophenyl)methylamino]methyl]-5-methoxyphenol
CID 61268747
4-methoxy-2-(2-methylphenoxy)benzenecarbothioamide
CID 81303184
(2-chlorophenyl) 2,5-dimethoxybenzenesulfonate
CID 172894052
(2S)-2-(2-chlorophenoxy)-3-(2,4-dimethoxyphenyl)propanoic acid
CID 100545306
azane;2-methoxyphenol
CID 172717837
(2-chlorophenyl)-(2,5-dimethoxyphenyl)methanone
CID 623894

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenoxy)-4-methoxyphenol?
The IUPAC name of 2-(2-chlorophenoxy)-4-methoxyphenol (CID 57036661) is 2-(2-chlorophenoxy)-4-methoxyphenol.
What is the SMILES notation for 2-(2-chlorophenoxy)-4-methoxyphenol?
The canonical SMILES for 2-(2-chlorophenoxy)-4-methoxyphenol is COc1ccc(O)c(Oc2ccccc2Cl)c1.
What is the InChIKey of 2-(2-chlorophenoxy)-4-methoxyphenol?
The InChIKey is LKFCHIBKIZQOAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11ClO3/c1-16-9-6-7-11(15)13(8-9)17-12-5-3-2-4-10(12)14/h2-8,15H,1H3.
What are the key properties of 2-(2-chlorophenoxy)-4-methoxyphenol?
2-(2-chlorophenoxy)-4-methoxyphenol has a molecular weight of 250.68 g/mol, XLogP of 3.85, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenoxy)-4-methoxyphenol is sourced from PubChem (CID 57036661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).