methane;methylbenzene;yttrium

C15H18Y-2 — CID 160876865

IUPACmethane;methylbenzene;yttrium
SMILESC.Cc1cc[c-]cc1.Cc1cc[c-]cc1.[Y]
InChIInChI=1S/2C7H7.CH4.Y/c2*1-7-5-3-2-4-6-7;;/h2*3-6H,1H3;1H4;/q2*-1;;
InChIKeyJILGRGXRAVOKBE-UHFFFAOYSA-N
MW287.22 g/mol
LogP4.22
Rot. Bonds

About methane;methylbenzene;yttrium

methane;methylbenzene;yttrium (PubChem CID 160876865) has the molecular formula C15H18Y-2 and a molecular weight of 287.22 g/mol. Its IUPAC name is methane;methylbenzene;yttrium.

Molecular Properties

Compound Namemethane;methylbenzene;yttrium
PubChem CID160876865
Molecular FormulaC15H18Y-2
Molecular Weight287.22 g/mol
Exact Mass287.05
IUPAC Namemethane;methylbenzene;yttrium
SMILESC.Cc1cc[c-]cc1.Cc1cc[c-]cc1.[Y]
InChIInChI=1S/2C7H7.CH4.Y/c2*1-7-5-3-2-4-6-7;;/h2*3-6H,1H3;1H4;/q2*-1;;
InChIKeyJILGRGXRAVOKBE-UHFFFAOYSA-N
XLogP4.22
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.22
LogP ≤ 54.22
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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Related Compounds

methane;methylbenzene;yttrium
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CID 22952606
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CID 59372723
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CID 163813971
potassium;boric acid;methylbenzene
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Frequently Asked Questions

What is the IUPAC name of methane;methylbenzene;yttrium?
The IUPAC name of methane;methylbenzene;yttrium (CID 160876865) is methane;methylbenzene;yttrium.
What is the SMILES notation for methane;methylbenzene;yttrium?
The canonical SMILES for methane;methylbenzene;yttrium is C.Cc1cc[c-]cc1.Cc1cc[c-]cc1.[Y].
What is the InChIKey of methane;methylbenzene;yttrium?
The InChIKey is JILGRGXRAVOKBE-UHFFFAOYSA-N. The full InChI is InChI=1S/2C7H7.CH4.Y/c2*1-7-5-3-2-4-6-7;;/h2*3-6H,1H3;1H4;/q2*-1;;.
What are the key properties of methane;methylbenzene;yttrium?
methane;methylbenzene;yttrium has a molecular weight of 287.22 g/mol, XLogP of 4.22, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methane;methylbenzene;yttrium is sourced from PubChem (CID 160876865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).