lithium;cyclopropane;ethoxyethane

C7H15LiO — CID 86744982

IUPAClithium;cyclopropane;ethoxyethane
SMILESCCOCC.[CH-]1CC1.[Li+]
InChIInChI=1S/C4H10O.C3H5.Li/c1-3-5-4-2;1-2-3-1;/h3-4H2,1-2H3;1H,2-3H2;/q;-1;+1
InChIKeyONEGNQMNNPAAEL-UHFFFAOYSA-N
MW122.14 g/mol
LogP-0.97
Rot. Bonds2

About lithium;cyclopropane;ethoxyethane

lithium;cyclopropane;ethoxyethane (PubChem CID 86744982) has the molecular formula C7H15LiO and a molecular weight of 122.14 g/mol. Its IUPAC name is lithium;cyclopropane;ethoxyethane.

Molecular Properties

Compound Namelithium;cyclopropane;ethoxyethane
PubChem CID86744982
Molecular FormulaC7H15LiO
Molecular Weight122.14 g/mol
Exact Mass122.13
IUPAC Namelithium;cyclopropane;ethoxyethane
SMILESCCOCC.[CH-]1CC1.[Li+]
InChIInChI=1S/C4H10O.C3H5.Li/c1-3-5-4-2;1-2-3-1;/h3-4H2,1-2H3;1H,2-3H2;/q;-1;+1
InChIKeyONEGNQMNNPAAEL-UHFFFAOYSA-N
XLogP-0.97
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.14
LogP ≤ 5-0.97
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 lithium;cyclopropane;ethoxyethane?
The IUPAC name of lithium;cyclopropane;ethoxyethane (CID 86744982) is lithium;cyclopropane;ethoxyethane.
What is the SMILES notation for lithium;cyclopropane;ethoxyethane?
The canonical SMILES for lithium;cyclopropane;ethoxyethane is CCOCC.[CH-]1CC1.[Li+].
What is the InChIKey of lithium;cyclopropane;ethoxyethane?
The InChIKey is ONEGNQMNNPAAEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10O.C3H5.Li/c1-3-5-4-2;1-2-3-1;/h3-4H2,1-2H3;1H,2-3H2;/q;-1;+1.
What are the key properties of lithium;cyclopropane;ethoxyethane?
lithium;cyclopropane;ethoxyethane has a molecular weight of 122.14 g/mol, XLogP of -0.97, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;cyclopropane;ethoxyethane is sourced from PubChem (CID 86744982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).