3,3-dimethyl-6-methylidene-4,5-dihydro-2H-pyran-4-ide;bis(yttrium)

C8H13OY2- — CID 58763803

IUPAC3,3-dimethyl-6-methylidene-4,5-dihydro-2H-pyran-4-ide;bis(yttrium)
SMILESC=C1C[CH-]C(C)(C)CO1.[Y].[Y]
InChIInChI=1S/C8H13O.2Y/c1-7-4-5-8(2,3)6-9-7;;/h5H,1,4,6H2,2-3H3;;/q-1;;
InChIKeyRUCJGCSRQHDTRO-UHFFFAOYSA-N
MW303.00 g/mol
LogP2.15
Rot. Bonds

About 3,3-dimethyl-6-methylidene-4,5-dihydro-2H-pyran-4-ide;bis(yttrium)

3,3-dimethyl-6-methylidene-4,5-dihydro-2H-pyran-4-ide;bis(yttrium) (PubChem CID 58763803) has the molecular formula C8H13OY2- and a molecular weight of 303.00 g/mol. Its IUPAC name is 3,3-dimethyl-6-methylidene-4,5-dihydro-2H-pyran-4-ide;bis(yttrium).

Molecular Properties

Compound Name3,3-dimethyl-6-methylidene-4,5-dihydro-2H-pyran-4-ide;bis(yttrium)
PubChem CID58763803
Molecular FormulaC8H13OY2-
Molecular Weight303.00 g/mol
Exact Mass302.91
IUPAC Name3,3-dimethyl-6-methylidene-4,5-dihydro-2H-pyran-4-ide;bis(yttrium)
SMILESC=C1C[CH-]C(C)(C)CO1.[Y].[Y]
InChIInChI=1S/C8H13O.2Y/c1-7-4-5-8(2,3)6-9-7;;/h5H,1,4,6H2,2-3H3;;/q-1;;
InChIKeyRUCJGCSRQHDTRO-UHFFFAOYSA-N
XLogP2.15
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.00
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 3,3-dimethyl-6-methylidene-4,5-dihydro-2H-pyran-4-ide;bis(yttrium)?
The IUPAC name of 3,3-dimethyl-6-methylidene-4,5-dihydro-2H-pyran-4-ide;bis(yttrium) (CID 58763803) is 3,3-dimethyl-6-methylidene-4,5-dihydro-2H-pyran-4-ide;bis(yttrium).
What is the SMILES notation for 3,3-dimethyl-6-methylidene-4,5-dihydro-2H-pyran-4-ide;bis(yttrium)?
The canonical SMILES for 3,3-dimethyl-6-methylidene-4,5-dihydro-2H-pyran-4-ide;bis(yttrium) is C=C1C[CH-]C(C)(C)CO1.[Y].[Y].
What is the InChIKey of 3,3-dimethyl-6-methylidene-4,5-dihydro-2H-pyran-4-ide;bis(yttrium)?
The InChIKey is RUCJGCSRQHDTRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13O.2Y/c1-7-4-5-8(2,3)6-9-7;;/h5H,1,4,6H2,2-3H3;;/q-1;;.
What are the key properties of 3,3-dimethyl-6-methylidene-4,5-dihydro-2H-pyran-4-ide;bis(yttrium)?
3,3-dimethyl-6-methylidene-4,5-dihydro-2H-pyran-4-ide;bis(yttrium) has a molecular weight of 303.00 g/mol, XLogP of 2.15, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethyl-6-methylidene-4,5-dihydro-2H-pyran-4-ide;bis(yttrium) is sourced from PubChem (CID 58763803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).