methanol;2H-naphthalen-2-ide;nickel

C11H11NiO- — CID 162415545

IUPACmethanol;2H-naphthalen-2-ide;nickel
SMILESCO.[Ni].[c-]1ccc2ccccc2c1
InChIInChI=1S/C10H7.CH4O.Ni/c1-2-6-10-8-4-3-7-9(10)5-1;1-2;/h1-3,5-8H;2H,1H3;/q-1;;
InChIKeyLAPFJDLIHNEXEX-UHFFFAOYSA-N
MW217.90 g/mol
LogP2.25
Rot. Bonds

About methanol;2H-naphthalen-2-ide;nickel

methanol;2H-naphthalen-2-ide;nickel (PubChem CID 162415545) has the molecular formula C11H11NiO- and a molecular weight of 217.90 g/mol. Its IUPAC name is methanol;2H-naphthalen-2-ide;nickel.

Molecular Properties

Compound Namemethanol;2H-naphthalen-2-ide;nickel
PubChem CID162415545
Molecular FormulaC11H11NiO-
Molecular Weight217.90 g/mol
Exact Mass217.02
IUPAC Namemethanol;2H-naphthalen-2-ide;nickel
SMILESCO.[Ni].[c-]1ccc2ccccc2c1
InChIInChI=1S/C10H7.CH4O.Ni/c1-2-6-10-8-4-3-7-9(10)5-1;1-2;/h1-3,5-8H;2H,1H3;/q-1;;
InChIKeyLAPFJDLIHNEXEX-UHFFFAOYSA-N
XLogP2.25
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.90
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of methanol;2H-naphthalen-2-ide;nickel?
The IUPAC name of methanol;2H-naphthalen-2-ide;nickel (CID 162415545) is methanol;2H-naphthalen-2-ide;nickel.
What is the SMILES notation for methanol;2H-naphthalen-2-ide;nickel?
The canonical SMILES for methanol;2H-naphthalen-2-ide;nickel is CO.[Ni].[c-]1ccc2ccccc2c1.
What is the InChIKey of methanol;2H-naphthalen-2-ide;nickel?
The InChIKey is LAPFJDLIHNEXEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7.CH4O.Ni/c1-2-6-10-8-4-3-7-9(10)5-1;1-2;/h1-3,5-8H;2H,1H3;/q-1;;.
What are the key properties of methanol;2H-naphthalen-2-ide;nickel?
methanol;2H-naphthalen-2-ide;nickel has a molecular weight of 217.90 g/mol, XLogP of 2.25, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methanol;2H-naphthalen-2-ide;nickel is sourced from PubChem (CID 162415545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).