disodium;hydride;tetradecanedioic acid

C14H28Na2O4 — CID 175393935

IUPACdisodium;hydride;tetradecanedioic acid
SMILESO=C(O)CCCCCCCCCCCCC(=O)O.[H-].[H-].[Na+].[Na+]
InChIInChI=1S/C14H26O4.2Na.2H/c15-13(16)11-9-7-5-3-1-2-4-6-8-10-12-14(17)18;;;;/h1-12H2,(H,15,16)(H,17,18);;;;/q;2*+1;2*-1
InChIKeyHUMQPYNYWFDBQV-UHFFFAOYSA-N
MW306.35 g/mol
LogP-1.93
Rot. Bonds13

About disodium;hydride;tetradecanedioic acid

disodium;hydride;tetradecanedioic acid (PubChem CID 175393935) has the molecular formula C14H28Na2O4 and a molecular weight of 306.35 g/mol. Its IUPAC name is disodium;hydride;tetradecanedioic acid.

Molecular Properties

Compound Namedisodium;hydride;tetradecanedioic acid
PubChem CID175393935
Molecular FormulaC14H28Na2O4
Molecular Weight306.35 g/mol
Exact Mass306.18
IUPAC Namedisodium;hydride;tetradecanedioic acid
SMILESO=C(O)CCCCCCCCCCCCC(=O)O.[H-].[H-].[Na+].[Na+]
InChIInChI=1S/C14H26O4.2Na.2H/c15-13(16)11-9-7-5-3-1-2-4-6-8-10-12-14(17)18;;;;/h1-12H2,(H,15,16)(H,17,18);;;;/q;2*+1;2*-1
InChIKeyHUMQPYNYWFDBQV-UHFFFAOYSA-N
XLogP-1.93
TPSA74.60 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.35
LogP ≤ 5-1.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

disodium;henicosanedioic acid;hydride
CID 174862400
sodium;decanedioic acid;hydride
CID 173004506
triacontanedioic acid
CID 5322010
decanedioic acid;hexanedioic acid;octanedioic acid
CID 159110511
heptadecanedioic acid
CID 3083765
decanedioic acid;hexanedioic acid;nonanedioic acid;octanedioic acid
CID 159068248
tridecanedioic acid;undecanedioic acid
CID 158333715
tetradecanedioic acid
CID 13185
decanedioic acid;tris(nonanedioic acid)
CID 159759294
dodecanedioic acid;bis(tridecanedioic acid)
CID 87373965
decanedioic acid;icosanedioic acid
CID 161217033
calcium;decanedioic acid;hydride;zinc
CID 174761072

Frequently Asked Questions

What is the IUPAC name of disodium;hydride;tetradecanedioic acid?
The IUPAC name of disodium;hydride;tetradecanedioic acid (CID 175393935) is disodium;hydride;tetradecanedioic acid.
What is the SMILES notation for disodium;hydride;tetradecanedioic acid?
The canonical SMILES for disodium;hydride;tetradecanedioic acid is O=C(O)CCCCCCCCCCCCC(=O)O.[H-].[H-].[Na+].[Na+].
What is the InChIKey of disodium;hydride;tetradecanedioic acid?
The InChIKey is HUMQPYNYWFDBQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26O4.2Na.2H/c15-13(16)11-9-7-5-3-1-2-4-6-8-10-12-14(17)18;;;;/h1-12H2,(H,15,16)(H,17,18);;;;/q;2*+1;2*-1.
What are the key properties of disodium;hydride;tetradecanedioic acid?
disodium;hydride;tetradecanedioic acid has a molecular weight of 306.35 g/mol, XLogP of -1.93, 13 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for disodium;hydride;tetradecanedioic acid is sourced from PubChem (CID 175393935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).