zinc;carbanide;cyclopenta-1,3-diene

C6H8Zn — CID 23116545

IUPACzinc;carbanide;cyclopenta-1,3-diene
SMILES[C-]1=CC=CC1.[CH3-].[Zn+2]
InChIInChI=1S/C5H5.CH3.Zn/c1-2-4-5-3-1;;/h1-3H,4H2;1H3;/q2*-1;+2
InChIKeyQIUVZISRGFJEFP-UHFFFAOYSA-N
MW145.52 g/mol
LogP1.75
Rot. Bonds

About zinc;carbanide;cyclopenta-1,3-diene

zinc;carbanide;cyclopenta-1,3-diene (PubChem CID 23116545) has the molecular formula C6H8Zn and a molecular weight of 145.52 g/mol. Its IUPAC name is zinc;carbanide;cyclopenta-1,3-diene.

Molecular Properties

Compound Namezinc;carbanide;cyclopenta-1,3-diene
PubChem CID23116545
Molecular FormulaC6H8Zn
Molecular Weight145.52 g/mol
Exact Mass143.99
IUPAC Namezinc;carbanide;cyclopenta-1,3-diene
SMILES[C-]1=CC=CC1.[CH3-].[Zn+2]
InChIInChI=1S/C5H5.CH3.Zn/c1-2-4-5-3-1;;/h1-3H,4H2;1H3;/q2*-1;+2
InChIKeyQIUVZISRGFJEFP-UHFFFAOYSA-N
XLogP1.75
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.52
LogP ≤ 51.75
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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Related Compounds

carbanide;bis(cyclopenta-1,3-diene);molybdenum(4+)
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carbanide;cyclopenta-1,3-diene;platinum(4+)
CID 53443065
carbanide;cyclopenta-1,3-diene;zinc
CID 173150447
carbanide;pentakis(cyclopenta-1,3-diene);platinum
CID 175422555
carbanide;cyclopenta-1,3-diene;iridium tetrahydride
CID 173399564
carbanide;cyclopenta-1,3-diene;osmium(2+)
CID 140608310
carbanide;cyclopenta-1,3-diene;hydride;titanium(3+)
CID 173197965
carbanide;cyclopenta-1,3-diene;hydride;zirconium(4+)
CID 174257873
carbanide;cyclopenta-1,3-diene;titanium(2+);hydrochloride
CID 174301832
carbanide;tris(cyclopenta-1,3-diene);tris(hafnium(4+));trihydrochloride
CID 173293314
azanide;carbanide;cyclopenta-1,3-diene;zirconium
CID 175410282
carbanide;cyclopenta-1,3-diene;titanium(4+);chloride
CID 87905674

Frequently Asked Questions

What is the IUPAC name of zinc;carbanide;cyclopenta-1,3-diene?
The IUPAC name of zinc;carbanide;cyclopenta-1,3-diene (CID 23116545) is zinc;carbanide;cyclopenta-1,3-diene.
What is the SMILES notation for zinc;carbanide;cyclopenta-1,3-diene?
The canonical SMILES for zinc;carbanide;cyclopenta-1,3-diene is [C-]1=CC=CC1.[CH3-].[Zn+2].
What is the InChIKey of zinc;carbanide;cyclopenta-1,3-diene?
The InChIKey is QIUVZISRGFJEFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5.CH3.Zn/c1-2-4-5-3-1;;/h1-3H,4H2;1H3;/q2*-1;+2.
What are the key properties of zinc;carbanide;cyclopenta-1,3-diene?
zinc;carbanide;cyclopenta-1,3-diene has a molecular weight of 145.52 g/mol, XLogP of 1.75, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for zinc;carbanide;cyclopenta-1,3-diene is sourced from PubChem (CID 23116545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).