dichloronickel;propane

C3H8Cl2Ni — CID 161255917

IUPACdichloronickel;propane
SMILESCCC.Cl[Ni]Cl
InChIInChI=1S/C3H8.2ClH.Ni/c1-3-2;;;/h3H2,1-2H3;2*1H;/q;;;+2/p-2
InChIKeyVBXJWRFADSRGDI-UHFFFAOYSA-L
MW173.70 g/mol
LogP2.79
Rot. Bonds

About dichloronickel;propane

dichloronickel;propane (PubChem CID 161255917) has the molecular formula C3H8Cl2Ni and a molecular weight of 173.70 g/mol. Its IUPAC name is dichloronickel;propane.

Molecular Properties

Compound Namedichloronickel;propane
PubChem CID161255917
Molecular FormulaC3H8Cl2Ni
Molecular Weight173.70 g/mol
Exact Mass171.94
IUPAC Namedichloronickel;propane
SMILESCCC.Cl[Ni]Cl
InChIInChI=1S/C3H8.2ClH.Ni/c1-3-2;;;/h3H2,1-2H3;2*1H;/q;;;+2/p-2
InChIKeyVBXJWRFADSRGDI-UHFFFAOYSA-L
XLogP2.79
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.70
LogP ≤ 52.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of dichloronickel;propane?
The IUPAC name of dichloronickel;propane (CID 161255917) is dichloronickel;propane.
What is the SMILES notation for dichloronickel;propane?
The canonical SMILES for dichloronickel;propane is CCC.Cl[Ni]Cl.
What is the InChIKey of dichloronickel;propane?
The InChIKey is VBXJWRFADSRGDI-UHFFFAOYSA-L. The full InChI is InChI=1S/C3H8.2ClH.Ni/c1-3-2;;;/h3H2,1-2H3;2*1H;/q;;;+2/p-2.
What are the key properties of dichloronickel;propane?
dichloronickel;propane has a molecular weight of 173.70 g/mol, XLogP of 2.79, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dichloronickel;propane is sourced from PubChem (CID 161255917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).