2-(2-chlorophenyl)benzene-1,3-diol

C12H9ClO2 — CID 163363337

IUPAC2-(2-chlorophenyl)benzene-1,3-diol
SMILESOc1cccc(O)c1-c1ccccc1Cl
InChIInChI=1S/C12H9ClO2/c13-9-5-2-1-4-8(9)12-10(14)6-3-7-11(12)15/h1-7,14-15H
InChIKeyBKNURZDJKNQZOK-UHFFFAOYSA-N
MW220.66 g/mol
LogP3.42
Rot. Bonds1

About 2-(2-chlorophenyl)benzene-1,3-diol

2-(2-chlorophenyl)benzene-1,3-diol (PubChem CID 163363337) has the molecular formula C12H9ClO2 and a molecular weight of 220.66 g/mol. Its IUPAC name is 2-(2-chlorophenyl)benzene-1,3-diol.

Molecular Properties

Compound Name2-(2-chlorophenyl)benzene-1,3-diol
PubChem CID163363337
Molecular FormulaC12H9ClO2
Molecular Weight220.66 g/mol
Exact Mass220.03
IUPAC Name2-(2-chlorophenyl)benzene-1,3-diol
SMILESOc1cccc(O)c1-c1ccccc1Cl
InChIInChI=1S/C12H9ClO2/c13-9-5-2-1-4-8(9)12-10(14)6-3-7-11(12)15/h1-7,14-15H
InChIKeyBKNURZDJKNQZOK-UHFFFAOYSA-N
XLogP3.42
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.66
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-chloro-2-(2-chlorophenyl)phenol
CID 69117513
2-(2-phenylphenyl)benzene-1,3-diol
CID 66853518
1-chloro-5-hydroxyanthracene-9,10-dione
CID 12631756
CID 87547372
CID 87547372
CID 173103986
CID 173103986
bis(2-chlorophenol);tungsten
CID 88625581
3-(2-chlorophenyl)-4-hydroxy-6-methyl-1H-pyridin-2-one
CID 54719903
sodium;3-(2,6-dichlorophenyl)-2-iodophenol;hydride
CID 173433912
2-(2-chlorophenyl)-3-methylaniline
CID 67904683
2,3-dichloronaphthalene-1,4-dione;2,3-dichlorophenol
CID 175429838
(2Z)-2-(4-chloro-5-hydroxyfluoren-9-ylidene)acetic acid
CID 82578817
3-(2-chlorophenyl)-7-hydroxy-2,8-dimethylchromen-4-one
CID 5350853

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)benzene-1,3-diol?
The IUPAC name of 2-(2-chlorophenyl)benzene-1,3-diol (CID 163363337) is 2-(2-chlorophenyl)benzene-1,3-diol.
What is the SMILES notation for 2-(2-chlorophenyl)benzene-1,3-diol?
The canonical SMILES for 2-(2-chlorophenyl)benzene-1,3-diol is Oc1cccc(O)c1-c1ccccc1Cl.
What is the InChIKey of 2-(2-chlorophenyl)benzene-1,3-diol?
The InChIKey is BKNURZDJKNQZOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9ClO2/c13-9-5-2-1-4-8(9)12-10(14)6-3-7-11(12)15/h1-7,14-15H.
What are the key properties of 2-(2-chlorophenyl)benzene-1,3-diol?
2-(2-chlorophenyl)benzene-1,3-diol has a molecular weight of 220.66 g/mol, XLogP of 3.42, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)benzene-1,3-diol is sourced from PubChem (CID 163363337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).