sodium;3-ethoxypropane-1,2-diol;hydride

C5H13NaO3 — CID 173234204

IUPACsodium;3-ethoxypropane-1,2-diol;hydride
SMILESCCOCC(O)CO.[H-].[Na+]
InChIInChI=1S/C5H12O3.Na.H/c1-2-8-4-5(7)3-6;;/h5-7H,2-4H2,1H3;;/q;+1;-1
InChIKeyHCIXWBYMMHCEAJ-UHFFFAOYSA-N
MW144.15 g/mol
LogP-3.51
Rot. Bonds4

About sodium;3-ethoxypropane-1,2-diol;hydride

sodium;3-ethoxypropane-1,2-diol;hydride (PubChem CID 173234204) has the molecular formula C5H13NaO3 and a molecular weight of 144.15 g/mol. Its IUPAC name is sodium;3-ethoxypropane-1,2-diol;hydride.

Molecular Properties

Compound Namesodium;3-ethoxypropane-1,2-diol;hydride
PubChem CID173234204
Molecular FormulaC5H13NaO3
Molecular Weight144.15 g/mol
Exact Mass144.08
IUPAC Namesodium;3-ethoxypropane-1,2-diol;hydride
SMILESCCOCC(O)CO.[H-].[Na+]
InChIInChI=1S/C5H12O3.Na.H/c1-2-8-4-5(7)3-6;;/h5-7H,2-4H2,1H3;;/q;+1;-1
InChIKeyHCIXWBYMMHCEAJ-UHFFFAOYSA-N
XLogP-3.51
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.15
LogP ≤ 5-3.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[2-(2-ethoxyethoxy)ethoxy]propane-1,2-diol
CID 57186683
ethoxyethane;decakis(propane-1,2,3-triol)
CID 173290324
3-(2,3-dihydroxypropoxy)propane-1,2-diol;propane-1,2,3-triol
CID 87090459
ethene;ethoxyethane;propane-1,2,3-triol
CID 175604440
3-decoxypropane-1,2-diol;ethoxyethane
CID 86708450
magnesium;3-(2,3-dihydroxypropoxy)propane-1,2-diol;dichloride
CID 174372262
3-(2,3-dihydroxypropoxymethoxy)propane-1,2-diol
CID 59854090
3-ethoxypropane-1,2-diol;octadecanoic acid
CID 174477085
1-ethoxypentan-2-ol
CID 21201051
ethyl 2-(2,3-dihydroxypropoxy)acetate
CID 57225948
3-[3-[3-[3-(2,3-dihydroxypropoxy)-2-hydroxypropoxy]-2-methylpropoxy]-2-hydroxypropoxy]propane-1,2-diol
CID 54295342
1-ethoxy-3-[(3-ethoxy-2-hydroxypropyl)amino]propan-2-ol
CID 139812156

Frequently Asked Questions

What is the IUPAC name of sodium;3-ethoxypropane-1,2-diol;hydride?
The IUPAC name of sodium;3-ethoxypropane-1,2-diol;hydride (CID 173234204) is sodium;3-ethoxypropane-1,2-diol;hydride.
What is the SMILES notation for sodium;3-ethoxypropane-1,2-diol;hydride?
The canonical SMILES for sodium;3-ethoxypropane-1,2-diol;hydride is CCOCC(O)CO.[H-].[Na+].
What is the InChIKey of sodium;3-ethoxypropane-1,2-diol;hydride?
The InChIKey is HCIXWBYMMHCEAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12O3.Na.H/c1-2-8-4-5(7)3-6;;/h5-7H,2-4H2,1H3;;/q;+1;-1.
What are the key properties of sodium;3-ethoxypropane-1,2-diol;hydride?
sodium;3-ethoxypropane-1,2-diol;hydride has a molecular weight of 144.15 g/mol, XLogP of -3.51, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;3-ethoxypropane-1,2-diol;hydride is sourced from PubChem (CID 173234204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).