2-(6-chloropyridazin-3-yl)-5-methoxyphenol

C11H9ClN2O2 — CID 135731737

IUPAC2-(6-chloropyridazin-3-yl)-5-methoxyphenol
SMILESCOc1ccc(-c2ccc(Cl)nn2)c(O)c1
InChIInChI=1S/C11H9ClN2O2/c1-16-7-2-3-8(10(15)6-7)9-4-5-11(12)14-13-9/h2-6,15H,1H3
InChIKeyJTEVRTFFPRBPHQ-UHFFFAOYSA-N
MW236.66 g/mol
LogP2.51
Rot. Bonds2

About 2-(6-chloropyridazin-3-yl)-5-methoxyphenol

2-(6-chloropyridazin-3-yl)-5-methoxyphenol (PubChem CID 135731737) has the molecular formula C11H9ClN2O2 and a molecular weight of 236.66 g/mol. Its IUPAC name is 2-(6-chloropyridazin-3-yl)-5-methoxyphenol.

Molecular Properties

Compound Name2-(6-chloropyridazin-3-yl)-5-methoxyphenol
PubChem CID135731737
Molecular FormulaC11H9ClN2O2
Molecular Weight236.66 g/mol
Exact Mass236.04
IUPAC Name2-(6-chloropyridazin-3-yl)-5-methoxyphenol
SMILESCOc1ccc(-c2ccc(Cl)nn2)c(O)c1
InChIInChI=1S/C11H9ClN2O2/c1-16-7-2-3-8(10(15)6-7)9-4-5-11(12)14-13-9/h2-6,15H,1H3
InChIKeyJTEVRTFFPRBPHQ-UHFFFAOYSA-N
XLogP2.51
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.66
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-methoxy-2-(4-methoxyphenyl)phenol
CID 10933283
2-(2,4-diaminophenyl)-4-methoxyphenol
CID 22061985
3-chloro-6-(3-methoxy-4-pyridinyl)pyridazine
CID 177188598
5-methoxy-2-(1,3,5-triazin-2-yl)phenol
CID 142648649
6-(4-methoxy-2-methylphenyl)pyridin-3-ol
CID 53229332
4-(2-chloro-4-methoxyphenyl)-1,3-thiazole
CID 4998959
2-[3-(2-hydroxy-4-methoxyphenyl)-5-(4-methoxyphenyl)phenyl]-5-methoxyphenol
CID 20730822
3-chloro-6-(3-methoxyphenoxy)pyridazine
CID 13321729
2-[4-(4-chloro-3-fluorophenyl)-6-(2-methylpropylamino)-2-pyridinyl]-5-methoxyphenol
CID 137290851
2-[2-amino-6-(2,4-dichlorophenyl)-4-pyridinyl]-5-methoxyphenol
CID 175922121
4-[4-(2-hydroxy-4-methoxyphenyl)-6-(2-hydroxyphenyl)-1,3,5-triazin-2-yl]benzene-1,3-diol
CID 136946080
N-(6-chloropyridazin-3-yl)-2,5-dimethoxybenzamide
CID 115608605

Frequently Asked Questions

What is the IUPAC name of 2-(6-chloropyridazin-3-yl)-5-methoxyphenol?
The IUPAC name of 2-(6-chloropyridazin-3-yl)-5-methoxyphenol (CID 135731737) is 2-(6-chloropyridazin-3-yl)-5-methoxyphenol.
What is the SMILES notation for 2-(6-chloropyridazin-3-yl)-5-methoxyphenol?
The canonical SMILES for 2-(6-chloropyridazin-3-yl)-5-methoxyphenol is COc1ccc(-c2ccc(Cl)nn2)c(O)c1.
What is the InChIKey of 2-(6-chloropyridazin-3-yl)-5-methoxyphenol?
The InChIKey is JTEVRTFFPRBPHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClN2O2/c1-16-7-2-3-8(10(15)6-7)9-4-5-11(12)14-13-9/h2-6,15H,1H3.
What are the key properties of 2-(6-chloropyridazin-3-yl)-5-methoxyphenol?
2-(6-chloropyridazin-3-yl)-5-methoxyphenol has a molecular weight of 236.66 g/mol, XLogP of 2.51, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-chloropyridazin-3-yl)-5-methoxyphenol is sourced from PubChem (CID 135731737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).