carbanide;cyclopenta-1,3-diene;zinc

C9H17Zn-5 — CID 173150447

IUPACcarbanide;cyclopenta-1,3-diene;zinc
SMILES[C-]1=CC=CC1.[CH3-].[CH3-].[CH3-].[CH3-].[Zn]
InChIInChI=1S/C5H5.4CH3.Zn/c1-2-4-5-3-1;;;;;/h1-3H,4H2;4*1H3;/q5*-1;
InChIKeyPPDWXMYFLNKKQP-UHFFFAOYSA-N
MW190.62 g/mol
LogP3.10
Rot. Bonds

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

carbanide;cyclopenta-1,3-diene;zinc (PubChem CID 173150447) has the molecular formula C9H17Zn-5 and a molecular weight of 190.62 g/mol. Its IUPAC name is carbanide;cyclopenta-1,3-diene;zinc.

Molecular Properties

Compound Namecarbanide;cyclopenta-1,3-diene;zinc
PubChem CID173150447
Molecular FormulaC9H17Zn-5
Molecular Weight190.62 g/mol
Exact Mass189.06
IUPAC Namecarbanide;cyclopenta-1,3-diene;zinc
SMILES[C-]1=CC=CC1.[CH3-].[CH3-].[CH3-].[CH3-].[Zn]
InChIInChI=1S/C5H5.4CH3.Zn/c1-2-4-5-3-1;;;;;/h1-3H,4H2;4*1H3;/q5*-1;
InChIKeyPPDWXMYFLNKKQP-UHFFFAOYSA-N
XLogP3.10
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.62
LogP ≤ 53.10
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+)
CID 175390139
carbanide;cyclopenta-1,3-diene;platinum(4+)
CID 53443065
zinc;carbanide;cyclopenta-1,3-diene
CID 23116545
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 carbanide;cyclopenta-1,3-diene;zinc?
The IUPAC name of carbanide;cyclopenta-1,3-diene;zinc (CID 173150447) is carbanide;cyclopenta-1,3-diene;zinc.
What is the SMILES notation for carbanide;cyclopenta-1,3-diene;zinc?
The canonical SMILES for carbanide;cyclopenta-1,3-diene;zinc is [C-]1=CC=CC1.[CH3-].[CH3-].[CH3-].[CH3-].[Zn].
What is the InChIKey of carbanide;cyclopenta-1,3-diene;zinc?
The InChIKey is PPDWXMYFLNKKQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5.4CH3.Zn/c1-2-4-5-3-1;;;;;/h1-3H,4H2;4*1H3;/q5*-1;.
What are the key properties of carbanide;cyclopenta-1,3-diene;zinc?
carbanide;cyclopenta-1,3-diene;zinc has a molecular weight of 190.62 g/mol, XLogP of 3.10, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;cyclopenta-1,3-diene;zinc is sourced from PubChem (CID 173150447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).