methanol;nickel;chloride

CH4ClNiO- — CID 22477147

IUPACmethanol;nickel;chloride
SMILESCO.[Cl-].[Ni]
InChIInChI=1S/CH4O.ClH.Ni/c1-2;;/h2H,1H3;1H;/p-1
InChIKeyJDGVOCVWKNRNKB-UHFFFAOYSA-M
MW126.19 g/mol
LogP-3.39
Rot. Bonds

About methanol;nickel;chloride

methanol;nickel;chloride (PubChem CID 22477147) has the molecular formula CH4ClNiO- and a molecular weight of 126.19 g/mol. Its IUPAC name is methanol;nickel;chloride.

Molecular Properties

Compound Namemethanol;nickel;chloride
PubChem CID22477147
Molecular FormulaCH4ClNiO-
Molecular Weight126.19 g/mol
Exact Mass124.93
IUPAC Namemethanol;nickel;chloride
SMILESCO.[Cl-].[Ni]
InChIInChI=1S/CH4O.ClH.Ni/c1-2;;/h2H,1H3;1H;/p-1
InChIKeyJDGVOCVWKNRNKB-UHFFFAOYSA-M
XLogP-3.39
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.19
LogP ≤ 5-3.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of methanol;nickel;chloride?
The IUPAC name of methanol;nickel;chloride (CID 22477147) is methanol;nickel;chloride.
What is the SMILES notation for methanol;nickel;chloride?
The canonical SMILES for methanol;nickel;chloride is CO.[Cl-].[Ni].
What is the InChIKey of methanol;nickel;chloride?
The InChIKey is JDGVOCVWKNRNKB-UHFFFAOYSA-M. The full InChI is InChI=1S/CH4O.ClH.Ni/c1-2;;/h2H,1H3;1H;/p-1.
What are the key properties of methanol;nickel;chloride?
methanol;nickel;chloride has a molecular weight of 126.19 g/mol, XLogP of -3.39, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methanol;nickel;chloride is sourced from PubChem (CID 22477147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).