cyclopenta-1,3-dien-1-ylmethyl(trimethyl)silane;hafnium;dichloride

C9H16Cl2HfSi-2 — CID 174968217

IUPACcyclopenta-1,3-dien-1-ylmethyl(trimethyl)silane;hafnium;dichloride
SMILESC[Si](C)(C)CC1=CC=CC1.[Cl-].[Cl-].[Hf]
InChIInChI=1S/C9H16Si.2ClH.Hf/c1-10(2,3)8-9-6-4-5-7-9;;;/h4-6H,7-8H2,1-3H3;2*1H;/p-2
InChIKeyJVUNLCIQNVLTIQ-UHFFFAOYSA-L
MW401.71 g/mol
LogP-2.78
Rot. Bonds2

About cyclopenta-1,3-dien-1-ylmethyl(trimethyl)silane;hafnium;dichloride

cyclopenta-1,3-dien-1-ylmethyl(trimethyl)silane;hafnium;dichloride (PubChem CID 174968217) has the molecular formula C9H16Cl2HfSi-2 and a molecular weight of 401.71 g/mol. Its IUPAC name is cyclopenta-1,3-dien-1-ylmethyl(trimethyl)silane;hafnium;dichloride.

Molecular Properties

Compound Namecyclopenta-1,3-dien-1-ylmethyl(trimethyl)silane;hafnium;dichloride
PubChem CID174968217
Molecular FormulaC9H16Cl2HfSi-2
Molecular Weight401.71 g/mol
Exact Mass401.99
IUPAC Namecyclopenta-1,3-dien-1-ylmethyl(trimethyl)silane;hafnium;dichloride
SMILESC[Si](C)(C)CC1=CC=CC1.[Cl-].[Cl-].[Hf]
InChIInChI=1S/C9H16Si.2ClH.Hf/c1-10(2,3)8-9-6-4-5-7-9;;;/h4-6H,7-8H2,1-3H3;2*1H;/p-2
InChIKeyJVUNLCIQNVLTIQ-UHFFFAOYSA-L
XLogP-2.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.71
LogP ≤ 5-2.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of cyclopenta-1,3-dien-1-ylmethyl(trimethyl)silane;hafnium;dichloride?
The IUPAC name of cyclopenta-1,3-dien-1-ylmethyl(trimethyl)silane;hafnium;dichloride (CID 174968217) is cyclopenta-1,3-dien-1-ylmethyl(trimethyl)silane;hafnium;dichloride.
What is the SMILES notation for cyclopenta-1,3-dien-1-ylmethyl(trimethyl)silane;hafnium;dichloride?
The canonical SMILES for cyclopenta-1,3-dien-1-ylmethyl(trimethyl)silane;hafnium;dichloride is C[Si](C)(C)CC1=CC=CC1.[Cl-].[Cl-].[Hf].
What is the InChIKey of cyclopenta-1,3-dien-1-ylmethyl(trimethyl)silane;hafnium;dichloride?
The InChIKey is JVUNLCIQNVLTIQ-UHFFFAOYSA-L. The full InChI is InChI=1S/C9H16Si.2ClH.Hf/c1-10(2,3)8-9-6-4-5-7-9;;;/h4-6H,7-8H2,1-3H3;2*1H;/p-2.
What are the key properties of cyclopenta-1,3-dien-1-ylmethyl(trimethyl)silane;hafnium;dichloride?
cyclopenta-1,3-dien-1-ylmethyl(trimethyl)silane;hafnium;dichloride has a molecular weight of 401.71 g/mol, XLogP of -2.78, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopenta-1,3-dien-1-ylmethyl(trimethyl)silane;hafnium;dichloride is sourced from PubChem (CID 174968217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).