disodium;hydride;icosanoic acid

C20H42Na2O2 — CID 175560905

IUPACdisodium;hydride;icosanoic acid
SMILESCCCCCCCCCCCCCCCCCCCC(=O)O.[H-].[H-].[Na+].[Na+]
InChIInChI=1S/C20H40O2.2Na.2H/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22;;;;/h2-19H2,1H3,(H,21,22);;;;/q;2*+1;2*-1
InChIKeyVZFCDGWIOFBXHG-UHFFFAOYSA-N
MW360.53 g/mol
LogP1.35
Rot. Bonds18

About disodium;hydride;icosanoic acid

disodium;hydride;icosanoic acid (PubChem CID 175560905) has the molecular formula C20H42Na2O2 and a molecular weight of 360.53 g/mol. Its IUPAC name is disodium;hydride;icosanoic acid.

Molecular Properties

Compound Namedisodium;hydride;icosanoic acid
PubChem CID175560905
Molecular FormulaC20H42Na2O2
Molecular Weight360.53 g/mol
Exact Mass360.30
IUPAC Namedisodium;hydride;icosanoic acid
SMILESCCCCCCCCCCCCCCCCCCCC(=O)O.[H-].[H-].[Na+].[Na+]
InChIInChI=1S/C20H40O2.2Na.2H/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22;;;;/h2-19H2,1H3,(H,21,22);;;;/q;2*+1;2*-1
InChIKeyVZFCDGWIOFBXHG-UHFFFAOYSA-N
XLogP1.35
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds18
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.53
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

sodium;decanoic acid;hydride;tetradecanoic acid
CID 173314479
disodium;hydride;tetradecanoic acid
CID 175149200
sodium;dodecanoic acid;hydride
CID 173060618
disodium;hexadecanoic acid;hydride;hydrate
CID 174056425
sodium;hydride;octanoic acid;selane
CID 174677652
barium(2+);hydride;tridecanoic acid
CID 174792677
calcium;hydride;tritriacontanoic acid
CID 173321714
dimagnesium;hydride;octadecanoic acid;tetradecanoic acid
CID 174909227
calcium;hydride;nonacosanoic acid
CID 173321722
calcium;hydride;bis(octanoic acid)
CID 174951959
calcium;dodecanoic acid;hydride
CID 172998116
sodium;carbanide;tetradecanoic acid
CID 160620546

Frequently Asked Questions

What is the IUPAC name of disodium;hydride;icosanoic acid?
The IUPAC name of disodium;hydride;icosanoic acid (CID 175560905) is disodium;hydride;icosanoic acid.
What is the SMILES notation for disodium;hydride;icosanoic acid?
The canonical SMILES for disodium;hydride;icosanoic acid is CCCCCCCCCCCCCCCCCCCC(=O)O.[H-].[H-].[Na+].[Na+].
What is the InChIKey of disodium;hydride;icosanoic acid?
The InChIKey is VZFCDGWIOFBXHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H40O2.2Na.2H/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22;;;;/h2-19H2,1H3,(H,21,22);;;;/q;2*+1;2*-1.
What are the key properties of disodium;hydride;icosanoic acid?
disodium;hydride;icosanoic acid has a molecular weight of 360.53 g/mol, XLogP of 1.35, 18 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for disodium;hydride;icosanoic acid is sourced from PubChem (CID 175560905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).