cyclopenta-2,4-dien-1-yl-tris(trifluoromethyl)germane;hafnium(4+);propylazanide

C17H28F9GeHfN3 — CID 150417350

IUPACcyclopenta-2,4-dien-1-yl-tris(trifluoromethyl)germane;hafnium(4+);propylazanide
SMILESCCC[NH-].CCC[NH-].CCC[NH-].FC(F)(F)[Ge]([c-]1cccc1)(C(F)(F)F)C(F)(F)F.[Hf+4]
InChIInChI=1S/C8H4F9Ge.3C3H8N.Hf/c9-6(10,11)18(7(12,13)14,8(15,16)17)5-3-1-2-4-5;3*1-2-3-4;/h1-4H;3*4H,2-3H2,1H3;/q4*-1;+4
InChIKeyHHBDFDKSSKHVTB-UHFFFAOYSA-N
MW696.51 g/mol
LogP7.71
Rot. Bonds4

About cyclopenta-2,4-dien-1-yl-tris(trifluoromethyl)germane;hafnium(4+);propylazanide

cyclopenta-2,4-dien-1-yl-tris(trifluoromethyl)germane;hafnium(4+);propylazanide (PubChem CID 150417350) has the molecular formula C17H28F9GeHfN3 and a molecular weight of 696.51 g/mol. Its IUPAC name is cyclopenta-2,4-dien-1-yl-tris(trifluoromethyl)germane;hafnium(4+);propylazanide.

Molecular Properties

Compound Namecyclopenta-2,4-dien-1-yl-tris(trifluoromethyl)germane;hafnium(4+);propylazanide
PubChem CID150417350
Molecular FormulaC17H28F9GeHfN3
Molecular Weight696.51 g/mol
Exact Mass699.08
IUPAC Namecyclopenta-2,4-dien-1-yl-tris(trifluoromethyl)germane;hafnium(4+);propylazanide
SMILESCCC[NH-].CCC[NH-].CCC[NH-].FC(F)(F)[Ge]([c-]1cccc1)(C(F)(F)F)C(F)(F)F.[Hf+4]
InChIInChI=1S/C8H4F9Ge.3C3H8N.Hf/c9-6(10,11)18(7(12,13)14,8(15,16)17)5-3-1-2-4-5;3*1-2-3-4;/h1-4H;3*4H,2-3H2,1H3;/q4*-1;+4
InChIKeyHHBDFDKSSKHVTB-UHFFFAOYSA-N
XLogP7.71
TPSA71.40 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500696.51
LogP ≤ 57.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze cyclopenta-2,4-dien-1-yl-tris(trifluoromethyl)germane;hafnium(4+);propylazanide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

cyclopenta-2,4-dien-1-yl-tris(trifluoromethyl)germane;tris(dibutylazanide);hafnium(4+)
CID 151558668
cyclopenta-2,4-dien-1-yl-tris(trifluoromethyl)germane;hafnium;methanol
CID 151205387
cyclopenta-2,4-dien-1-yl(fluoro)silane;hafnium(4+);propylazanide
CID 152538193
cyclopenta-2,4-dien-1-yl(fluoro)germane;propylazanide;zirconium(4+)
CID 151954500
cyclopenta-2,4-dien-1-yl-bis(trifluoromethyl)silane;ethylazanide;hafnium(4+)
CID 151659534
cyclopenta-2,4-dien-1-yl(fluoro)germane;ethylazanide;hafnium(4+)
CID 150619843
cyclopenta-2,4-dien-1-yl(trifluoro)germane;ethanol;zirconium
CID 151276224
magnesium;benzene;propylazanide
CID 177409494
tripropoxy(trifluoromethyl)germane
CID 150077463
cyclopenta-2,4-dien-1-yl-fluoro-dimethylsilane;tris(dibutylazanide);hafnium(4+)
CID 150734564
cyclopenta-2,4-dien-1-yl(fluoro)silane;ethyl(methyl)azanide;hafnium(4+)
CID 151586771
ethanol;hafnium;propylazanide
CID 87157076

Frequently Asked Questions

What is the IUPAC name of cyclopenta-2,4-dien-1-yl-tris(trifluoromethyl)germane;hafnium(4+);propylazanide?
The IUPAC name of cyclopenta-2,4-dien-1-yl-tris(trifluoromethyl)germane;hafnium(4+);propylazanide (CID 150417350) is cyclopenta-2,4-dien-1-yl-tris(trifluoromethyl)germane;hafnium(4+);propylazanide.
What is the SMILES notation for cyclopenta-2,4-dien-1-yl-tris(trifluoromethyl)germane;hafnium(4+);propylazanide?
The canonical SMILES for cyclopenta-2,4-dien-1-yl-tris(trifluoromethyl)germane;hafnium(4+);propylazanide is CCC[NH-].CCC[NH-].CCC[NH-].FC(F)(F)[Ge]([c-]1cccc1)(C(F)(F)F)C(F)(F)F.[Hf+4].
What is the InChIKey of cyclopenta-2,4-dien-1-yl-tris(trifluoromethyl)germane;hafnium(4+);propylazanide?
The InChIKey is HHBDFDKSSKHVTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H4F9Ge.3C3H8N.Hf/c9-6(10,11)18(7(12,13)14,8(15,16)17)5-3-1-2-4-5;3*1-2-3-4;/h1-4H;3*4H,2-3H2,1H3;/q4*-1;+4.
What are the key properties of cyclopenta-2,4-dien-1-yl-tris(trifluoromethyl)germane;hafnium(4+);propylazanide?
cyclopenta-2,4-dien-1-yl-tris(trifluoromethyl)germane;hafnium(4+);propylazanide has a molecular weight of 696.51 g/mol, XLogP of 7.71, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopenta-2,4-dien-1-yl-tris(trifluoromethyl)germane;hafnium(4+);propylazanide is sourced from PubChem (CID 150417350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).