bis(dipropylazanide);hafnium(4+);dibromide

C12H28Br2HfN2 — CID 159357494

IUPACbis(dipropylazanide);hafnium(4+);dibromide
SMILESCCC[N-]CCC.CCC[N-]CCC.[Br-].[Br-].[Hf+4]
InChIInChI=1S/2C6H14N.2BrH.Hf/c2*1-3-5-7-6-4-2;;;/h2*3-6H2,1-2H3;2*1H;/q2*-1;;;+4/p-2
InChIKeyMAIWUBLCRJWCSW-UHFFFAOYSA-L
MW538.67 g/mol
LogP-1.63
Rot. Bonds8

About bis(dipropylazanide);hafnium(4+);dibromide

bis(dipropylazanide);hafnium(4+);dibromide (PubChem CID 159357494) has the molecular formula C12H28Br2HfN2 and a molecular weight of 538.67 g/mol. Its IUPAC name is bis(dipropylazanide);hafnium(4+);dibromide.

Molecular Properties

Compound Namebis(dipropylazanide);hafnium(4+);dibromide
PubChem CID159357494
Molecular FormulaC12H28Br2HfN2
Molecular Weight538.67 g/mol
Exact Mass538.01
IUPAC Namebis(dipropylazanide);hafnium(4+);dibromide
SMILESCCC[N-]CCC.CCC[N-]CCC.[Br-].[Br-].[Hf+4]
InChIInChI=1S/2C6H14N.2BrH.Hf/c2*1-3-5-7-6-4-2;;;/h2*3-6H2,1-2H3;2*1H;/q2*-1;;;+4/p-2
InChIKeyMAIWUBLCRJWCSW-UHFFFAOYSA-L
XLogP-1.63
TPSA28.20 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms17
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500538.67
LogP ≤ 5-1.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bis(dipropylazanide);hafnium(4+);dibromide?
The IUPAC name of bis(dipropylazanide);hafnium(4+);dibromide (CID 159357494) is bis(dipropylazanide);hafnium(4+);dibromide.
What is the SMILES notation for bis(dipropylazanide);hafnium(4+);dibromide?
The canonical SMILES for bis(dipropylazanide);hafnium(4+);dibromide is CCC[N-]CCC.CCC[N-]CCC.[Br-].[Br-].[Hf+4].
What is the InChIKey of bis(dipropylazanide);hafnium(4+);dibromide?
The InChIKey is MAIWUBLCRJWCSW-UHFFFAOYSA-L. The full InChI is InChI=1S/2C6H14N.2BrH.Hf/c2*1-3-5-7-6-4-2;;;/h2*3-6H2,1-2H3;2*1H;/q2*-1;;;+4/p-2.
What are the key properties of bis(dipropylazanide);hafnium(4+);dibromide?
bis(dipropylazanide);hafnium(4+);dibromide has a molecular weight of 538.67 g/mol, XLogP of -1.63, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(dipropylazanide);hafnium(4+);dibromide is sourced from PubChem (CID 159357494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).