chloromethane;nickel

C4H8Cl4Ni-4 — CID 163830168

IUPACchloromethane;nickel
SMILES[CH2-]Cl.[CH2-]Cl.[CH2-]Cl.[CH2-]Cl.[Ni]
InChIInChI=1S/4CH2Cl.Ni/c4*1-2;/h4*1H2;/q4*-1;
InChIKeyROPSOXYMTMXCTH-UHFFFAOYSA-N
MW256.61 g/mol
LogP4.06
Rot. Bonds

About chloromethane;nickel

chloromethane;nickel (PubChem CID 163830168) has the molecular formula C4H8Cl4Ni-4 and a molecular weight of 256.61 g/mol. Its IUPAC name is chloromethane;nickel.

Molecular Properties

Compound Namechloromethane;nickel
PubChem CID163830168
Molecular FormulaC4H8Cl4Ni-4
Molecular Weight256.61 g/mol
Exact Mass253.88
IUPAC Namechloromethane;nickel
SMILES[CH2-]Cl.[CH2-]Cl.[CH2-]Cl.[CH2-]Cl.[Ni]
InChIInChI=1S/4CH2Cl.Ni/c4*1-2;/h4*1H2;/q4*-1;
InChIKeyROPSOXYMTMXCTH-UHFFFAOYSA-N
XLogP4.06
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.61
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 chloromethane;nickel?
The IUPAC name of chloromethane;nickel (CID 163830168) is chloromethane;nickel.
What is the SMILES notation for chloromethane;nickel?
The canonical SMILES for chloromethane;nickel is [CH2-]Cl.[CH2-]Cl.[CH2-]Cl.[CH2-]Cl.[Ni].
What is the InChIKey of chloromethane;nickel?
The InChIKey is ROPSOXYMTMXCTH-UHFFFAOYSA-N. The full InChI is InChI=1S/4CH2Cl.Ni/c4*1-2;/h4*1H2;/q4*-1;.
What are the key properties of chloromethane;nickel?
chloromethane;nickel has a molecular weight of 256.61 g/mol, XLogP of 4.06, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloromethane;nickel is sourced from PubChem (CID 163830168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).