lithium;chlorozinc(1+);methoxybenzene;chloride

C7H7Cl2LiOZn — CID 135077159

IUPAClithium;chlorozinc(1+);methoxybenzene;chloride
SMILESCOc1cc[c-]cc1.Cl[Zn+].[Cl-].[Li+]
InChIInChI=1S/C7H7O.2ClH.Li.Zn/c1-8-7-5-3-2-4-6-7;;;;/h3-6H,1H3;2*1H;;/q-1;;;+1;+2/p-2
InChIKeyOPXGFKPSVGZUCO-UHFFFAOYSA-L
MW250.37 g/mol
LogP-3.81
Rot. Bonds1

About lithium;chlorozinc(1+);methoxybenzene;chloride

lithium;chlorozinc(1+);methoxybenzene;chloride (PubChem CID 135077159) has the molecular formula C7H7Cl2LiOZn and a molecular weight of 250.37 g/mol. Its IUPAC name is lithium;chlorozinc(1+);methoxybenzene;chloride.

Molecular Properties

Compound Namelithium;chlorozinc(1+);methoxybenzene;chloride
PubChem CID135077159
Molecular FormulaC7H7Cl2LiOZn
Molecular Weight250.37 g/mol
Exact Mass247.93
IUPAC Namelithium;chlorozinc(1+);methoxybenzene;chloride
SMILESCOc1cc[c-]cc1.Cl[Zn+].[Cl-].[Li+]
InChIInChI=1S/C7H7O.2ClH.Li.Zn/c1-8-7-5-3-2-4-6-7;;;;/h3-6H,1H3;2*1H;;/q-1;;;+1;+2/p-2
InChIKeyOPXGFKPSVGZUCO-UHFFFAOYSA-L
XLogP-3.81
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.37
LogP ≤ 5-3.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of lithium;chlorozinc(1+);methoxybenzene;chloride?
The IUPAC name of lithium;chlorozinc(1+);methoxybenzene;chloride (CID 135077159) is lithium;chlorozinc(1+);methoxybenzene;chloride.
What is the SMILES notation for lithium;chlorozinc(1+);methoxybenzene;chloride?
The canonical SMILES for lithium;chlorozinc(1+);methoxybenzene;chloride is COc1cc[c-]cc1.Cl[Zn+].[Cl-].[Li+].
What is the InChIKey of lithium;chlorozinc(1+);methoxybenzene;chloride?
The InChIKey is OPXGFKPSVGZUCO-UHFFFAOYSA-L. The full InChI is InChI=1S/C7H7O.2ClH.Li.Zn/c1-8-7-5-3-2-4-6-7;;;;/h3-6H,1H3;2*1H;;/q-1;;;+1;+2/p-2.
What are the key properties of lithium;chlorozinc(1+);methoxybenzene;chloride?
lithium;chlorozinc(1+);methoxybenzene;chloride has a molecular weight of 250.37 g/mol, XLogP of -3.81, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;chlorozinc(1+);methoxybenzene;chloride is sourced from PubChem (CID 135077159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).