carbanylium;ethane;methane

C11H37+ — CID 157056432

IUPACcarbanylium;ethane;methane
SMILESC.C.C.C.CC.CC.CC.[CH3+]
InChIInChI=1S/3C2H6.4CH4.CH3/c3*1-2;;;;;/h3*1-2H3;4*1H4;1H3/q;;;;;;;+1
InChIKeyAAUSPPRAACZUTI-UHFFFAOYSA-N
MW169.42 g/mol
LogP6.07
Rot. Bonds

About carbanylium;ethane;methane

carbanylium;ethane;methane (PubChem CID 157056432) has the molecular formula C11H37+ and a molecular weight of 169.42 g/mol. Its IUPAC name is carbanylium;ethane;methane.

Molecular Properties

Compound Namecarbanylium;ethane;methane
PubChem CID157056432
Molecular FormulaC11H37+
Molecular Weight169.42 g/mol
Exact Mass169.29
IUPAC Namecarbanylium;ethane;methane
SMILESC.C.C.C.CC.CC.CC.[CH3+]
InChIInChI=1S/3C2H6.4CH4.CH3/c3*1-2;;;;;/h3*1-2H3;4*1H4;1H3/q;;;;;;;+1
InChIKeyAAUSPPRAACZUTI-UHFFFAOYSA-N
XLogP6.07
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500169.42
LogP ≤ 56.07
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 carbanylium;ethane;methane?
The IUPAC name of carbanylium;ethane;methane (CID 157056432) is carbanylium;ethane;methane.
What is the SMILES notation for carbanylium;ethane;methane?
The canonical SMILES for carbanylium;ethane;methane is C.C.C.C.CC.CC.CC.[CH3+].
What is the InChIKey of carbanylium;ethane;methane?
The InChIKey is AAUSPPRAACZUTI-UHFFFAOYSA-N. The full InChI is InChI=1S/3C2H6.4CH4.CH3/c3*1-2;;;;;/h3*1-2H3;4*1H4;1H3/q;;;;;;;+1.
What are the key properties of carbanylium;ethane;methane?
carbanylium;ethane;methane has a molecular weight of 169.42 g/mol, XLogP of 6.07, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for carbanylium;ethane;methane is sourced from PubChem (CID 157056432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).