lithium;hydride;tetradec-9-enoic acid

C14H27LiO2 — CID 173353076

IUPAClithium;hydride;tetradec-9-enoic acid
SMILESCCCCC=CCCCCCCCC(=O)O.[H-].[Li+]
InChIInChI=1S/C14H26O2.Li.H/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16;;/h5-6H,2-4,7-13H2,1H3,(H,15,16);;/q;+1;-1
InChIKeyREYHEBLGHKIDFL-UHFFFAOYSA-N
MW234.31 g/mol
LogP1.66
Rot. Bonds11

About lithium;hydride;tetradec-9-enoic acid

lithium;hydride;tetradec-9-enoic acid (PubChem CID 173353076) has the molecular formula C14H27LiO2 and a molecular weight of 234.31 g/mol. Its IUPAC name is lithium;hydride;tetradec-9-enoic acid.

Molecular Properties

Compound Namelithium;hydride;tetradec-9-enoic acid
PubChem CID173353076
Molecular FormulaC14H27LiO2
Molecular Weight234.31 g/mol
Exact Mass234.22
IUPAC Namelithium;hydride;tetradec-9-enoic acid
SMILESCCCCC=CCCCCCCCC(=O)O.[H-].[Li+]
InChIInChI=1S/C14H26O2.Li.H/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16;;/h5-6H,2-4,7-13H2,1H3,(H,15,16);;/q;+1;-1
InChIKeyREYHEBLGHKIDFL-UHFFFAOYSA-N
XLogP1.66
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.31
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

dilithium;hydride;(Z)-octadec-9-enoic acid
CID 174491446
(E)-tetradec-9-enoic acid
CID 5312402
(E)-hexadec-11-enoic acid
CID 5312413
(E)-tricos-18-enoic acid
CID 20847589
(E)-nonadec-14-enoic acid
CID 101410255
iron;(Z)-octadec-13-enoic acid
CID 175306655
nickel;bis((Z)-tetradec-9-enoic acid)
CID 155704204
erbium;(Z)-tetradec-9-enoic acid
CID 155169208
lanthanum;tris((Z)-tetradec-9-enoic acid)
CID 155704268
dysprosium;tris((Z)-tetradec-9-enoic acid)
CID 155704207
praseodymium;(Z)-tetradec-9-enoic acid
CID 155169102
tetradecanoic acid;tetradec-9-enoic acid
CID 162088286

Frequently Asked Questions

What is the IUPAC name of lithium;hydride;tetradec-9-enoic acid?
The IUPAC name of lithium;hydride;tetradec-9-enoic acid (CID 173353076) is lithium;hydride;tetradec-9-enoic acid.
What is the SMILES notation for lithium;hydride;tetradec-9-enoic acid?
The canonical SMILES for lithium;hydride;tetradec-9-enoic acid is CCCCC=CCCCCCCCC(=O)O.[H-].[Li+].
What is the InChIKey of lithium;hydride;tetradec-9-enoic acid?
The InChIKey is REYHEBLGHKIDFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26O2.Li.H/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16;;/h5-6H,2-4,7-13H2,1H3,(H,15,16);;/q;+1;-1.
What are the key properties of lithium;hydride;tetradec-9-enoic acid?
lithium;hydride;tetradec-9-enoic acid has a molecular weight of 234.31 g/mol, XLogP of 1.66, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;hydride;tetradec-9-enoic acid is sourced from PubChem (CID 173353076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).