bromozinc(1+);ethane

C2H5BrZn — CID 10965035

IUPACbromozinc(1+);ethane
SMILES[CH2-]C.[Zn+]Br
InChIInChI=1S/C2H5.BrH.Zn/c1-2;;/h1H2,2H3;1H;/q-1;;+2/p-1
InChIKeyJTTKGHMBIYUSHN-UHFFFAOYSA-M
MW174.36 g/mol
LogP1.68
Rot. Bonds

About bromozinc(1+);ethane

bromozinc(1+);ethane (PubChem CID 10965035) has the molecular formula C2H5BrZn and a molecular weight of 174.36 g/mol. Its IUPAC name is bromozinc(1+);ethane.

Molecular Properties

Compound Namebromozinc(1+);ethane
PubChem CID10965035
Molecular FormulaC2H5BrZn
Molecular Weight174.36 g/mol
Exact Mass171.89
IUPAC Namebromozinc(1+);ethane
SMILES[CH2-]C.[Zn+]Br
InChIInChI=1S/C2H5.BrH.Zn/c1-2;;/h1H2,2H3;1H;/q-1;;+2/p-1
InChIKeyJTTKGHMBIYUSHN-UHFFFAOYSA-M
XLogP1.68
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.36
LogP ≤ 51.68
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 bromozinc(1+);ethane?
The IUPAC name of bromozinc(1+);ethane (CID 10965035) is bromozinc(1+);ethane.
What is the SMILES notation for bromozinc(1+);ethane?
The canonical SMILES for bromozinc(1+);ethane is [CH2-]C.[Zn+]Br.
What is the InChIKey of bromozinc(1+);ethane?
The InChIKey is JTTKGHMBIYUSHN-UHFFFAOYSA-M. The full InChI is InChI=1S/C2H5.BrH.Zn/c1-2;;/h1H2,2H3;1H;/q-1;;+2/p-1.
What are the key properties of bromozinc(1+);ethane?
bromozinc(1+);ethane has a molecular weight of 174.36 g/mol, XLogP of 1.68, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bromozinc(1+);ethane is sourced from PubChem (CID 10965035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).