sodium;1,2-diethoxyethane;hydride

C6H15NaO2 — CID 174903036

IUPACsodium;1,2-diethoxyethane;hydride
SMILESCCOCCOCC.[H-].[Na+]
InChIInChI=1S/C6H14O2.Na.H/c1-3-7-5-6-8-4-2;;/h3-6H2,1-2H3;;/q;+1;-1
InChIKeyLAMMQIBVIBOHFT-UHFFFAOYSA-N
MW142.17 g/mol
LogP-1.82
Rot. Bonds5

About sodium;1,2-diethoxyethane;hydride

sodium;1,2-diethoxyethane;hydride (PubChem CID 174903036) has the molecular formula C6H15NaO2 and a molecular weight of 142.17 g/mol. Its IUPAC name is sodium;1,2-diethoxyethane;hydride.

Molecular Properties

Compound Namesodium;1,2-diethoxyethane;hydride
PubChem CID174903036
Molecular FormulaC6H15NaO2
Molecular Weight142.17 g/mol
Exact Mass142.10
IUPAC Namesodium;1,2-diethoxyethane;hydride
SMILESCCOCCOCC.[H-].[Na+]
InChIInChI=1S/C6H14O2.Na.H/c1-3-7-5-6-8-4-2;;/h3-6H2,1-2H3;;/q;+1;-1
InChIKeyLAMMQIBVIBOHFT-UHFFFAOYSA-N
XLogP-1.82
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.17
LogP ≤ 5-1.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1,2-diethoxyethane;hydrofluoride
CID 175535770
1,2-diethoxyethane;ethene
CID 158825770
calcium;sodium;ethoxyethane;hydride
CID 173354921
1-[2-[2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propane
CID 88861501
disodium;azanide;2-ethoxyethanol;hydride
CID 173429143
sodium 2-(2-ethoxyethoxy)ethanolate
CID 23709816
disodium;ethoxyethane
CID 23107014
calcium;2-(2-ethoxyethoxy)ethanol;hydride
CID 174899431
1-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]-2-methoxyethane
CID 19982973
bis(1-ethoxy-2-methoxyethane);hydrate
CID 88797439
1,2-diethoxyethane;oxirane
CID 159897663
1,2-diethoxyethane;ethenamine
CID 160675526

Frequently Asked Questions

What is the IUPAC name of sodium;1,2-diethoxyethane;hydride?
The IUPAC name of sodium;1,2-diethoxyethane;hydride (CID 174903036) is sodium;1,2-diethoxyethane;hydride.
What is the SMILES notation for sodium;1,2-diethoxyethane;hydride?
The canonical SMILES for sodium;1,2-diethoxyethane;hydride is CCOCCOCC.[H-].[Na+].
What is the InChIKey of sodium;1,2-diethoxyethane;hydride?
The InChIKey is LAMMQIBVIBOHFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14O2.Na.H/c1-3-7-5-6-8-4-2;;/h3-6H2,1-2H3;;/q;+1;-1.
What are the key properties of sodium;1,2-diethoxyethane;hydride?
sodium;1,2-diethoxyethane;hydride has a molecular weight of 142.17 g/mol, XLogP of -1.82, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;1,2-diethoxyethane;hydride is sourced from PubChem (CID 174903036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).