lithium;cyclohexanone;hydride

C6H11LiO — CID 173089649

IUPAClithium;cyclohexanone;hydride
SMILESO=C1CCCCC1.[H-].[Li+]
InChIInChI=1S/C6H10O.Li.H/c7-6-4-2-1-3-5-6;;/h1-5H2;;/q;+1;-1
InChIKeyPDTMJVJZGJOCAM-UHFFFAOYSA-N
MW106.09 g/mol
LogP-1.36
Rot. Bonds

About lithium;cyclohexanone;hydride

lithium;cyclohexanone;hydride (PubChem CID 173089649) has the molecular formula C6H11LiO and a molecular weight of 106.09 g/mol. Its IUPAC name is lithium;cyclohexanone;hydride.

Molecular Properties

Compound Namelithium;cyclohexanone;hydride
PubChem CID173089649
Molecular FormulaC6H11LiO
Molecular Weight106.09 g/mol
Exact Mass106.10
IUPAC Namelithium;cyclohexanone;hydride
SMILESO=C1CCCCC1.[H-].[Li+]
InChIInChI=1S/C6H10O.Li.H/c7-6-4-2-1-3-5-6;;/h1-5H2;;/q;+1;-1
InChIKeyPDTMJVJZGJOCAM-UHFFFAOYSA-N
XLogP-1.36
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500106.09
LogP ≤ 5-1.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of lithium;cyclohexanone;hydride?
The IUPAC name of lithium;cyclohexanone;hydride (CID 173089649) is lithium;cyclohexanone;hydride.
What is the SMILES notation for lithium;cyclohexanone;hydride?
The canonical SMILES for lithium;cyclohexanone;hydride is O=C1CCCCC1.[H-].[Li+].
What is the InChIKey of lithium;cyclohexanone;hydride?
The InChIKey is PDTMJVJZGJOCAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10O.Li.H/c7-6-4-2-1-3-5-6;;/h1-5H2;;/q;+1;-1.
What are the key properties of lithium;cyclohexanone;hydride?
lithium;cyclohexanone;hydride has a molecular weight of 106.09 g/mol, XLogP of -1.36, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;cyclohexanone;hydride is sourced from PubChem (CID 173089649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).