2-chloro-5-(2-fluoro-4-methoxyphenyl)phenol

C13H10ClFO2 — CID 53221331

IUPAC2-chloro-5-(2-fluoro-4-methoxyphenyl)phenol
SMILESCOc1ccc(-c2ccc(Cl)c(O)c2)c(F)c1
InChIInChI=1S/C13H10ClFO2/c1-17-9-3-4-10(12(15)7-9)8-2-5-11(14)13(16)6-8/h2-7,16H,1H3
InChIKeyZGZYJOXLQXFZDY-UHFFFAOYSA-N
MW252.67 g/mol
LogP3.86
Rot. Bonds2

About 2-chloro-5-(2-fluoro-4-methoxyphenyl)phenol

2-chloro-5-(2-fluoro-4-methoxyphenyl)phenol (PubChem CID 53221331) has the molecular formula C13H10ClFO2 and a molecular weight of 252.67 g/mol. Its IUPAC name is 2-chloro-5-(2-fluoro-4-methoxyphenyl)phenol.

Molecular Properties

Compound Name2-chloro-5-(2-fluoro-4-methoxyphenyl)phenol
PubChem CID53221331
Molecular FormulaC13H10ClFO2
Molecular Weight252.67 g/mol
Exact Mass252.04
IUPAC Name2-chloro-5-(2-fluoro-4-methoxyphenyl)phenol
SMILESCOc1ccc(-c2ccc(Cl)c(O)c2)c(F)c1
InChIInChI=1S/C13H10ClFO2/c1-17-9-3-4-10(12(15)7-9)8-2-5-11(14)13(16)6-8/h2-7,16H,1H3
InChIKeyZGZYJOXLQXFZDY-UHFFFAOYSA-N
XLogP3.86
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.67
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(2-fluoro-4-methoxyphenyl)-2-methoxyphenol
CID 53220882
2-chloro-5-(2,4-difluorophenyl)phenol
CID 53221267
2-fluoro-1-(4-fluorophenyl)-4-methoxybenzene
CID 46312221
2-chloro-5-(2-fluorophenyl)phenol
CID 46314345
2-fluoro-5-(2-fluoro-4-methoxyphenyl)benzaldehyde
CID 54910502
2-(4-chlorophenyl)-4-methoxyphenol
CID 57199343
5-methoxy-2-(4-methoxyphenyl)phenol
CID 10933283
2-(2-fluoro-4-methoxyphenyl)-4-methylphenol
CID 83130401
[4-(2-fluoro-4-methoxyphenyl)phenyl]methanamine
CID 61034326
2-(2-fluoro-4-methoxyphenyl)-5-(trifluoromethyl)phenol
CID 172907025
4-(2,5-dimethoxyphenyl)-2-fluorophenol
CID 53219549
4-(2-fluoro-4-methoxyphenyl)-2-methylbenzonitrile
CID 172648631

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-(2-fluoro-4-methoxyphenyl)phenol?
The IUPAC name of 2-chloro-5-(2-fluoro-4-methoxyphenyl)phenol (CID 53221331) is 2-chloro-5-(2-fluoro-4-methoxyphenyl)phenol.
What is the SMILES notation for 2-chloro-5-(2-fluoro-4-methoxyphenyl)phenol?
The canonical SMILES for 2-chloro-5-(2-fluoro-4-methoxyphenyl)phenol is COc1ccc(-c2ccc(Cl)c(O)c2)c(F)c1.
What is the InChIKey of 2-chloro-5-(2-fluoro-4-methoxyphenyl)phenol?
The InChIKey is ZGZYJOXLQXFZDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10ClFO2/c1-17-9-3-4-10(12(15)7-9)8-2-5-11(14)13(16)6-8/h2-7,16H,1H3.
What are the key properties of 2-chloro-5-(2-fluoro-4-methoxyphenyl)phenol?
2-chloro-5-(2-fluoro-4-methoxyphenyl)phenol has a molecular weight of 252.67 g/mol, XLogP of 3.86, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-(2-fluoro-4-methoxyphenyl)phenol is sourced from PubChem (CID 53221331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).