4-methanidyl-2,2-dimethylpentane;yttrium

C8H16Y-2 — CID 59107436

IUPAC4-methanidyl-2,2-dimethylpentane;yttrium
SMILES[CH2-]C([CH2-])CC(C)(C)C.[Y]
InChIInChI=1S/C8H16.Y/c1-7(2)6-8(3,4)5;/h7H,1-2,6H2,3-5H3;/q-2;
InChIKeyGQTJUAXJHDZZFD-UHFFFAOYSA-N
MW201.12 g/mol
LogP2.70
Rot. Bonds1

About 4-methanidyl-2,2-dimethylpentane;yttrium

4-methanidyl-2,2-dimethylpentane;yttrium (PubChem CID 59107436) has the molecular formula C8H16Y-2 and a molecular weight of 201.12 g/mol. Its IUPAC name is 4-methanidyl-2,2-dimethylpentane;yttrium.

Molecular Properties

Compound Name4-methanidyl-2,2-dimethylpentane;yttrium
PubChem CID59107436
Molecular FormulaC8H16Y-2
Molecular Weight201.12 g/mol
Exact Mass201.03
IUPAC Name4-methanidyl-2,2-dimethylpentane;yttrium
SMILES[CH2-]C([CH2-])CC(C)(C)C.[Y]
InChIInChI=1S/C8H16.Y/c1-7(2)6-8(3,4)5;/h7H,1-2,6H2,3-5H3;/q-2;
InChIKeyGQTJUAXJHDZZFD-UHFFFAOYSA-N
XLogP2.70
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.12
LogP ≤ 52.70
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 4-methanidyl-2,2-dimethylpentane;yttrium?
The IUPAC name of 4-methanidyl-2,2-dimethylpentane;yttrium (CID 59107436) is 4-methanidyl-2,2-dimethylpentane;yttrium.
What is the SMILES notation for 4-methanidyl-2,2-dimethylpentane;yttrium?
The canonical SMILES for 4-methanidyl-2,2-dimethylpentane;yttrium is [CH2-]C([CH2-])CC(C)(C)C.[Y].
What is the InChIKey of 4-methanidyl-2,2-dimethylpentane;yttrium?
The InChIKey is GQTJUAXJHDZZFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16.Y/c1-7(2)6-8(3,4)5;/h7H,1-2,6H2,3-5H3;/q-2;.
What are the key properties of 4-methanidyl-2,2-dimethylpentane;yttrium?
4-methanidyl-2,2-dimethylpentane;yttrium has a molecular weight of 201.12 g/mol, XLogP of 2.70, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methanidyl-2,2-dimethylpentane;yttrium is sourced from PubChem (CID 59107436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).