methylbenzene;methylbenzene;rutherfordium

C14H14Rf-2 — CID 59021339

IUPACmethylbenzene;methylbenzene;rutherfordium
SMILESCc1c[c-]ccc1.Cc1cc[c-]cc1.[Rf]
InChIInChI=1S/2C7H7.Rf/c2*1-7-5-3-2-4-6-7;/h3-6H,1H3;2-3,5-6H,1H3;/q2*-1;
InChIKeyAIZCXTAVOPPAAZ-UHFFFAOYSA-N
MW449.27 g/mol
LogP3.59
Rot. Bonds

About methylbenzene;methylbenzene;rutherfordium

methylbenzene;methylbenzene;rutherfordium (PubChem CID 59021339) has the molecular formula C14H14Rf-2 and a molecular weight of 449.27 g/mol. Its IUPAC name is methylbenzene;methylbenzene;rutherfordium.

Molecular Properties

Compound Namemethylbenzene;methylbenzene;rutherfordium
PubChem CID59021339
Molecular FormulaC14H14Rf-2
Molecular Weight449.27 g/mol
Exact Mass449.23
IUPAC Namemethylbenzene;methylbenzene;rutherfordium
SMILESCc1c[c-]ccc1.Cc1cc[c-]cc1.[Rf]
InChIInChI=1S/2C7H7.Rf/c2*1-7-5-3-2-4-6-7;/h3-6H,1H3;2-3,5-6H,1H3;/q2*-1;
InChIKeyAIZCXTAVOPPAAZ-UHFFFAOYSA-N
XLogP3.59
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500449.27
LogP ≤ 53.59
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 methylbenzene;methylbenzene;rutherfordium?
The IUPAC name of methylbenzene;methylbenzene;rutherfordium (CID 59021339) is methylbenzene;methylbenzene;rutherfordium.
What is the SMILES notation for methylbenzene;methylbenzene;rutherfordium?
The canonical SMILES for methylbenzene;methylbenzene;rutherfordium is Cc1c[c-]ccc1.Cc1cc[c-]cc1.[Rf].
What is the InChIKey of methylbenzene;methylbenzene;rutherfordium?
The InChIKey is AIZCXTAVOPPAAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C7H7.Rf/c2*1-7-5-3-2-4-6-7;/h3-6H,1H3;2-3,5-6H,1H3;/q2*-1;.
What are the key properties of methylbenzene;methylbenzene;rutherfordium?
methylbenzene;methylbenzene;rutherfordium has a molecular weight of 449.27 g/mol, XLogP of 3.59, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methylbenzene;methylbenzene;rutherfordium is sourced from PubChem (CID 59021339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).