tris(ethane-1,2-diol);ethoxyethane

C10H28O7 — CID 173395808

IUPACtris(ethane-1,2-diol);ethoxyethane
SMILESCCOCC.OCCO.OCCO.OCCO
InChIInChI=1S/C4H10O.3C2H6O2/c1-3-5-4-2;3*3-1-2-4/h3-4H2,1-2H3;3*3-4H,1-2H2
InChIKeyNDSKMQQMXUQAFJ-UHFFFAOYSA-N
MW260.33 g/mol
LogP-2.04
Rot. Bonds5

About tris(ethane-1,2-diol);ethoxyethane

tris(ethane-1,2-diol);ethoxyethane (PubChem CID 173395808) has the molecular formula C10H28O7 and a molecular weight of 260.33 g/mol. Its IUPAC name is tris(ethane-1,2-diol);ethoxyethane.

Molecular Properties

Compound Nametris(ethane-1,2-diol);ethoxyethane
PubChem CID173395808
Molecular FormulaC10H28O7
Molecular Weight260.33 g/mol
Exact Mass260.18
IUPAC Nametris(ethane-1,2-diol);ethoxyethane
SMILESCCOCC.OCCO.OCCO.OCCO
InChIInChI=1S/C4H10O.3C2H6O2/c1-3-5-4-2;3*3-1-2-4/h3-4H2,1-2H3;3*3-4H,1-2H2
InChIKeyNDSKMQQMXUQAFJ-UHFFFAOYSA-N
XLogP-2.04
TPSA130.61 Ų
H-Bond Donors6
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500260.33
LogP ≤ 5-2.04
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 107

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Related Compounds

ethane-1,2-diol;ethene;ethoxyethane
CID 173171004
ethane-1,2-diol;ethene;ethoxyethane
CID 173009607
ethane-1,2-diol;ethoxyethane;prop-1-ene
CID 87195266
bis(ethane-1,2-diol);ethoxyethane;bis(prop-1-ene)
CID 173332144
ethoxyethane
CID 18694919
ethoxyethane
CID 19002445
ethanol;ethene;ethoxyethane
CID 139434375
ethoxyethane;hydroxylamine
CID 135816400
2-[bis(2-hydroxyethyl)amino]ethanol;ethoxyethane
CID 22156510
ethoxyethane;sulfane
CID 90240371
ethoxyethane;sulfane
CID 87243372
ethoxyethane;pentahydrate
CID 141041283

Frequently Asked Questions

What is the IUPAC name of tris(ethane-1,2-diol);ethoxyethane?
The IUPAC name of tris(ethane-1,2-diol);ethoxyethane (CID 173395808) is tris(ethane-1,2-diol);ethoxyethane.
What is the SMILES notation for tris(ethane-1,2-diol);ethoxyethane?
The canonical SMILES for tris(ethane-1,2-diol);ethoxyethane is CCOCC.OCCO.OCCO.OCCO.
What is the InChIKey of tris(ethane-1,2-diol);ethoxyethane?
The InChIKey is NDSKMQQMXUQAFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10O.3C2H6O2/c1-3-5-4-2;3*3-1-2-4/h3-4H2,1-2H3;3*3-4H,1-2H2.
What are the key properties of tris(ethane-1,2-diol);ethoxyethane?
tris(ethane-1,2-diol);ethoxyethane has a molecular weight of 260.33 g/mol, XLogP of -2.04, 5 rotatable bonds, 6 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for tris(ethane-1,2-diol);ethoxyethane is sourced from PubChem (CID 173395808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).