2-(3-chloro-4-hydroxyphenyl)indazol-5-ol

C13H9ClN2O2 — CID 11184545

IUPAC2-(3-chloro-4-hydroxyphenyl)indazol-5-ol
SMILESOc1ccc2nn(-c3ccc(O)c(Cl)c3)cc2c1
InChIInChI=1S/C13H9ClN2O2/c14-11-6-9(1-4-13(11)18)16-7-8-5-10(17)2-3-12(8)15-16/h1-7,17-18H
InChIKeyWPHSNSQBQGDRIT-UHFFFAOYSA-N
MW260.68 g/mol
LogP3.09
Rot. Bonds1

About 2-(3-chloro-4-hydroxyphenyl)indazol-5-ol

2-(3-chloro-4-hydroxyphenyl)indazol-5-ol (PubChem CID 11184545) has the molecular formula C13H9ClN2O2 and a molecular weight of 260.68 g/mol. Its IUPAC name is 2-(3-chloro-4-hydroxyphenyl)indazol-5-ol.

Molecular Properties

Compound Name2-(3-chloro-4-hydroxyphenyl)indazol-5-ol
PubChem CID11184545
Molecular FormulaC13H9ClN2O2
Molecular Weight260.68 g/mol
Exact Mass260.04
IUPAC Name2-(3-chloro-4-hydroxyphenyl)indazol-5-ol
SMILESOc1ccc2nn(-c3ccc(O)c(Cl)c3)cc2c1
InChIInChI=1S/C13H9ClN2O2/c14-11-6-9(1-4-13(11)18)16-7-8-5-10(17)2-3-12(8)15-16/h1-7,17-18H
InChIKeyWPHSNSQBQGDRIT-UHFFFAOYSA-N
XLogP3.09
TPSA58.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.68
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-chloro-4-hydroxyphenyl)indazol-5-ol?
The IUPAC name of 2-(3-chloro-4-hydroxyphenyl)indazol-5-ol (CID 11184545) is 2-(3-chloro-4-hydroxyphenyl)indazol-5-ol.
What is the SMILES notation for 2-(3-chloro-4-hydroxyphenyl)indazol-5-ol?
The canonical SMILES for 2-(3-chloro-4-hydroxyphenyl)indazol-5-ol is Oc1ccc2nn(-c3ccc(O)c(Cl)c3)cc2c1.
What is the InChIKey of 2-(3-chloro-4-hydroxyphenyl)indazol-5-ol?
The InChIKey is WPHSNSQBQGDRIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9ClN2O2/c14-11-6-9(1-4-13(11)18)16-7-8-5-10(17)2-3-12(8)15-16/h1-7,17-18H.
What are the key properties of 2-(3-chloro-4-hydroxyphenyl)indazol-5-ol?
2-(3-chloro-4-hydroxyphenyl)indazol-5-ol has a molecular weight of 260.68 g/mol, XLogP of 3.09, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chloro-4-hydroxyphenyl)indazol-5-ol is sourced from PubChem (CID 11184545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).