dichloro(pyridin-2-yl)methanol;zirconium

C6H5Cl2NOZr — CID 174374690

IUPACdichloro(pyridin-2-yl)methanol;zirconium
SMILESOC(Cl)(Cl)c1ccccn1.[Zr]
InChIInChI=1S/C6H5Cl2NO.Zr/c7-6(8,10)5-3-1-2-4-9-5;/h1-4,10H;
InChIKeyPZTWABXJLGIKMC-UHFFFAOYSA-N
MW269.24 g/mol
LogP1.66
Rot. Bonds1

About dichloro(pyridin-2-yl)methanol;zirconium

dichloro(pyridin-2-yl)methanol;zirconium (PubChem CID 174374690) has the molecular formula C6H5Cl2NOZr and a molecular weight of 269.24 g/mol. Its IUPAC name is dichloro(pyridin-2-yl)methanol;zirconium.

Molecular Properties

Compound Namedichloro(pyridin-2-yl)methanol;zirconium
PubChem CID174374690
Molecular FormulaC6H5Cl2NOZr
Molecular Weight269.24 g/mol
Exact Mass266.88
IUPAC Namedichloro(pyridin-2-yl)methanol;zirconium
SMILESOC(Cl)(Cl)c1ccccn1.[Zr]
InChIInChI=1S/C6H5Cl2NO.Zr/c7-6(8,10)5-3-1-2-4-9-5;/h1-4,10H;
InChIKeyPZTWABXJLGIKMC-UHFFFAOYSA-N
XLogP1.66
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.24
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

2-[dichloro(phenyl)methyl]pyridine
CID 25254083
CID 162723245
CID 162723245
(4-chlorophenyl)-dipyridin-2-ylmethanol
CID 142751464
1-pyridin-2-ylpropane-1,1-diol
CID 18373059
1,1,3,3-tetrafluoro-2-pyridin-2-ylpropan-2-ol
CID 153440698
bis(dipyridin-2-ylmethanediol);nickel(2+);dinitrate
CID 139076627
ethane;2-methyl-1,1-dipyridin-2-ylpropan-1-ol
CID 142343342
2-(2-chloro-1,1,1-trifluoropropan-2-yl)pyridine
CID 146396997
(2S)-3-methyl-2-pyridin-2-ylbutan-2-ol
CID 162467836
dihydroxy(pyridin-2-yl)methanesulfonic acid
CID 174297836
2-hydroxy-3-methyl-2-pyridin-2-ylbutanoic acid
CID 83698678
(1S)-2,2,2-trifluoro-1-phenyl-1-pyridin-2-ylethanol
CID 7018024

Frequently Asked Questions

What is the IUPAC name of dichloro(pyridin-2-yl)methanol;zirconium?
The IUPAC name of dichloro(pyridin-2-yl)methanol;zirconium (CID 174374690) is dichloro(pyridin-2-yl)methanol;zirconium.
What is the SMILES notation for dichloro(pyridin-2-yl)methanol;zirconium?
The canonical SMILES for dichloro(pyridin-2-yl)methanol;zirconium is OC(Cl)(Cl)c1ccccn1.[Zr].
What is the InChIKey of dichloro(pyridin-2-yl)methanol;zirconium?
The InChIKey is PZTWABXJLGIKMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5Cl2NO.Zr/c7-6(8,10)5-3-1-2-4-9-5;/h1-4,10H;.
What are the key properties of dichloro(pyridin-2-yl)methanol;zirconium?
dichloro(pyridin-2-yl)methanol;zirconium has a molecular weight of 269.24 g/mol, XLogP of 1.66, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dichloro(pyridin-2-yl)methanol;zirconium is sourced from PubChem (CID 174374690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).