1-[1-hydroxyethoxy(oxo)silyl]oxyethanol

C4H10O5Si — CID 21245488

IUPAC1-[1-hydroxyethoxy(oxo)silyl]oxyethanol
SMILESCC(O)O[Si](=O)OC(C)O
InChIInChI=1S/C4H10O5Si/c1-3(5)8-10(7)9-4(2)6/h3-6H,1-2H3
InChIKeyCQRZLZMYLWUHDY-UHFFFAOYSA-N
MW166.20 g/mol
LogP-0.89
Rot. Bonds4

About 1-[1-hydroxyethoxy(oxo)silyl]oxyethanol

1-[1-hydroxyethoxy(oxo)silyl]oxyethanol (PubChem CID 21245488) has the molecular formula C4H10O5Si and a molecular weight of 166.20 g/mol. Its IUPAC name is 1-[1-hydroxyethoxy(oxo)silyl]oxyethanol.

Molecular Properties

Compound Name1-[1-hydroxyethoxy(oxo)silyl]oxyethanol
PubChem CID21245488
Molecular FormulaC4H10O5Si
Molecular Weight166.20 g/mol
Exact Mass166.03
IUPAC Name1-[1-hydroxyethoxy(oxo)silyl]oxyethanol
SMILESCC(O)O[Si](=O)OC(C)O
InChIInChI=1S/C4H10O5Si/c1-3(5)8-10(7)9-4(2)6/h3-6H,1-2H3
InChIKeyCQRZLZMYLWUHDY-UHFFFAOYSA-N
XLogP-0.89
TPSA75.99 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.20
LogP ≤ 5-0.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

Calcium hydroxy ethoxide
CID 129776813
1,1'-Peroxydi(ethan-1-ol)
CID 54085263
Tetraethoxysilane hydroxide
CID 129772620
1-[Hydroxy(oxo)silyl]oxybutan-1-ol
CID 20285656
1-[1-Hydroxypropoxy(oxo)silyl]oxypropan-1-ol
CID 21245489
1-(Silyloxy)ethan-1-ol
CID 22342397
1-[1-Hydroxyethoxy(dimethyl)silyl]oxyethanol
CID 59066807
1-[Diethoxy(methyl)silyl]oxyethanol
CID 59066808
1-Silyloxyethanol
CID 71342736
Ethyl orthosilicate ethanol
CID 86742090
Ethane-1,1-diol;ethanol
CID 87329927
Ethanol;ethoxy-hydroxy-oxosilane
CID 87450344

Frequently Asked Questions

What is the IUPAC name of 1-[1-hydroxyethoxy(oxo)silyl]oxyethanol?
The IUPAC name of 1-[1-hydroxyethoxy(oxo)silyl]oxyethanol (CID 21245488) is 1-[1-hydroxyethoxy(oxo)silyl]oxyethanol.
What is the SMILES notation for 1-[1-hydroxyethoxy(oxo)silyl]oxyethanol?
The canonical SMILES for 1-[1-hydroxyethoxy(oxo)silyl]oxyethanol is CC(O)O[Si](=O)OC(C)O.
What is the InChIKey of 1-[1-hydroxyethoxy(oxo)silyl]oxyethanol?
The InChIKey is CQRZLZMYLWUHDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10O5Si/c1-3(5)8-10(7)9-4(2)6/h3-6H,1-2H3.
What are the key properties of 1-[1-hydroxyethoxy(oxo)silyl]oxyethanol?
1-[1-hydroxyethoxy(oxo)silyl]oxyethanol has a molecular weight of 166.20 g/mol, XLogP of -0.89, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-hydroxyethoxy(oxo)silyl]oxyethanol is sourced from PubChem (CID 21245488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).