lithium;cyclooctanecarboxylic acid;hydride

C9H17LiO2 — CID 173424430

IUPAClithium;cyclooctanecarboxylic acid;hydride
SMILESO=C(O)C1CCCCCCC1.[H-].[Li+]
InChIInChI=1S/C9H16O2.Li.H/c10-9(11)8-6-4-2-1-3-5-7-8;;/h8H,1-7H2,(H,10,11);;/q;+1;-1
InChIKeyFJMYXSJIGJZICL-UHFFFAOYSA-N
MW164.17 g/mol
LogP-0.45
Rot. Bonds1

About lithium;cyclooctanecarboxylic acid;hydride

lithium;cyclooctanecarboxylic acid;hydride (PubChem CID 173424430) has the molecular formula C9H17LiO2 and a molecular weight of 164.17 g/mol. Its IUPAC name is lithium;cyclooctanecarboxylic acid;hydride.

Molecular Properties

Compound Namelithium;cyclooctanecarboxylic acid;hydride
PubChem CID173424430
Molecular FormulaC9H17LiO2
Molecular Weight164.17 g/mol
Exact Mass164.14
IUPAC Namelithium;cyclooctanecarboxylic acid;hydride
SMILESO=C(O)C1CCCCCCC1.[H-].[Li+]
InChIInChI=1S/C9H16O2.Li.H/c10-9(11)8-6-4-2-1-3-5-7-8;;/h8H,1-7H2,(H,10,11);;/q;+1;-1
InChIKeyFJMYXSJIGJZICL-UHFFFAOYSA-N
XLogP-0.45
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.17
LogP ≤ 5-0.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 53471629
cyclopentanecarboxylic acid
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chloromethane;cyclohexanecarboxylic acid
CID 160928112
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Frequently Asked Questions

What is the IUPAC name of lithium;cyclooctanecarboxylic acid;hydride?
The IUPAC name of lithium;cyclooctanecarboxylic acid;hydride (CID 173424430) is lithium;cyclooctanecarboxylic acid;hydride.
What is the SMILES notation for lithium;cyclooctanecarboxylic acid;hydride?
The canonical SMILES for lithium;cyclooctanecarboxylic acid;hydride is O=C(O)C1CCCCCCC1.[H-].[Li+].
What is the InChIKey of lithium;cyclooctanecarboxylic acid;hydride?
The InChIKey is FJMYXSJIGJZICL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16O2.Li.H/c10-9(11)8-6-4-2-1-3-5-7-8;;/h8H,1-7H2,(H,10,11);;/q;+1;-1.
What are the key properties of lithium;cyclooctanecarboxylic acid;hydride?
lithium;cyclooctanecarboxylic acid;hydride has a molecular weight of 164.17 g/mol, XLogP of -0.45, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;cyclooctanecarboxylic acid;hydride is sourced from PubChem (CID 173424430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).