ethane;3-methyl-2H-naphthalen-2-ide;rhenium

C13H15Re- — CID 169166845

IUPACethane;3-methyl-2H-naphthalen-2-ide;rhenium
SMILESCC.Cc1[c-]cc2ccccc2c1.[Re]
InChIInChI=1S/C11H9.C2H6.Re/c1-9-6-7-10-4-2-3-5-11(10)8-9;1-2;/h2-5,7-8H,1H3;1-2H3;/q-1;;
InChIKeyMAZRJAIEHOZYTM-UHFFFAOYSA-N
MW357.47 g/mol
LogP3.97
Rot. Bonds

About ethane;3-methyl-2H-naphthalen-2-ide;rhenium

ethane;3-methyl-2H-naphthalen-2-ide;rhenium (PubChem CID 169166845) has the molecular formula C13H15Re- and a molecular weight of 357.47 g/mol. Its IUPAC name is ethane;3-methyl-2H-naphthalen-2-ide;rhenium.

Molecular Properties

Compound Nameethane;3-methyl-2H-naphthalen-2-ide;rhenium
PubChem CID169166845
Molecular FormulaC13H15Re-
Molecular Weight357.47 g/mol
Exact Mass358.07
IUPAC Nameethane;3-methyl-2H-naphthalen-2-ide;rhenium
SMILESCC.Cc1[c-]cc2ccccc2c1.[Re]
InChIInChI=1S/C11H9.C2H6.Re/c1-9-6-7-10-4-2-3-5-11(10)8-9;1-2;/h2-5,7-8H,1H3;1-2H3;/q-1;;
InChIKeyMAZRJAIEHOZYTM-UHFFFAOYSA-N
XLogP3.97
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.47
LogP ≤ 53.97
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

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CID 158474185

Frequently Asked Questions

What is the IUPAC name of ethane;3-methyl-2H-naphthalen-2-ide;rhenium?
The IUPAC name of ethane;3-methyl-2H-naphthalen-2-ide;rhenium (CID 169166845) is ethane;3-methyl-2H-naphthalen-2-ide;rhenium.
What is the SMILES notation for ethane;3-methyl-2H-naphthalen-2-ide;rhenium?
The canonical SMILES for ethane;3-methyl-2H-naphthalen-2-ide;rhenium is CC.Cc1[c-]cc2ccccc2c1.[Re].
What is the InChIKey of ethane;3-methyl-2H-naphthalen-2-ide;rhenium?
The InChIKey is MAZRJAIEHOZYTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9.C2H6.Re/c1-9-6-7-10-4-2-3-5-11(10)8-9;1-2;/h2-5,7-8H,1H3;1-2H3;/q-1;;.
What are the key properties of ethane;3-methyl-2H-naphthalen-2-ide;rhenium?
ethane;3-methyl-2H-naphthalen-2-ide;rhenium has a molecular weight of 357.47 g/mol, XLogP of 3.97, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-methyl-2H-naphthalen-2-ide;rhenium is sourced from PubChem (CID 169166845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).