hafnium;methanidylbenzene

C7H7Hf- — CID 57417385

IUPAChafnium;methanidylbenzene
SMILES[CH2-]c1ccccc1.[Hf]
InChIInChI=1S/C7H7.Hf/c1-7-5-3-2-4-6-7;/h2-6H,1H2;/q-1;
InChIKeySOEHBXKXNWTIMK-UHFFFAOYSA-N
MW269.62 g/mol
LogP1.87
Rot. Bonds

About hafnium;methanidylbenzene

hafnium;methanidylbenzene (PubChem CID 57417385) has the molecular formula C7H7Hf- and a molecular weight of 269.62 g/mol. Its IUPAC name is hafnium;methanidylbenzene.

Molecular Properties

Compound Namehafnium;methanidylbenzene
PubChem CID57417385
Molecular FormulaC7H7Hf-
Molecular Weight269.62 g/mol
Exact Mass271.00
IUPAC Namehafnium;methanidylbenzene
SMILES[CH2-]c1ccccc1.[Hf]
InChIInChI=1S/C7H7.Hf/c1-7-5-3-2-4-6-7;/h2-6H,1H2;/q-1;
InChIKeySOEHBXKXNWTIMK-UHFFFAOYSA-N
XLogP1.87
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.62
LogP ≤ 51.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of hafnium;methanidylbenzene?
The IUPAC name of hafnium;methanidylbenzene (CID 57417385) is hafnium;methanidylbenzene.
What is the SMILES notation for hafnium;methanidylbenzene?
The canonical SMILES for hafnium;methanidylbenzene is [CH2-]c1ccccc1.[Hf].
What is the InChIKey of hafnium;methanidylbenzene?
The InChIKey is SOEHBXKXNWTIMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7.Hf/c1-7-5-3-2-4-6-7;/h2-6H,1H2;/q-1;.
What are the key properties of hafnium;methanidylbenzene?
hafnium;methanidylbenzene has a molecular weight of 269.62 g/mol, XLogP of 1.87, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for hafnium;methanidylbenzene is sourced from PubChem (CID 57417385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).