zinc propane

C6H14Zn — CID 5207587

IUPACzinc propane
SMILESC[CH-]C.C[CH-]C.[Zn+2]
InChIInChI=1S/2C3H7.Zn/c2*1-3-2;/h2*3H,1-2H3;/q2*-1;+2
InChIKeyFRLYMSHUDNORBC-UHFFFAOYSA-N
MW151.57 g/mol
LogP2.46
Rot. Bonds

About zinc propane

zinc propane (PubChem CID 5207587) has the molecular formula C6H14Zn and a molecular weight of 151.57 g/mol. Its IUPAC name is zinc propane.

Molecular Properties

Compound Namezinc propane
PubChem CID5207587
Molecular FormulaC6H14Zn
Molecular Weight151.57 g/mol
Exact Mass150.04
IUPAC Namezinc propane
SMILESC[CH-]C.C[CH-]C.[Zn+2]
InChIInChI=1S/2C3H7.Zn/c2*1-3-2;/h2*3H,1-2H3;/q2*-1;+2
InChIKeyFRLYMSHUDNORBC-UHFFFAOYSA-N
XLogP2.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.57
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of zinc propane?
The IUPAC name of zinc propane (CID 5207587) is zinc propane.
What is the SMILES notation for zinc propane?
The canonical SMILES for zinc propane is C[CH-]C.C[CH-]C.[Zn+2].
What is the InChIKey of zinc propane?
The InChIKey is FRLYMSHUDNORBC-UHFFFAOYSA-N. The full InChI is InChI=1S/2C3H7.Zn/c2*1-3-2;/h2*3H,1-2H3;/q2*-1;+2.
What are the key properties of zinc propane?
zinc propane has a molecular weight of 151.57 g/mol, XLogP of 2.46, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for zinc propane is sourced from PubChem (CID 5207587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).