(3-ethoxysilyloxiran-2-yl)methanol

C5H12O3Si — CID 174908758

IUPAC(3-ethoxysilyloxiran-2-yl)methanol
SMILESCCO[SiH2]C1OC1CO
InChIInChI=1S/C5H12O3Si/c1-2-7-9-5-4(3-6)8-5/h4-6H,2-3,9H2,1H3
InChIKeyGBCNNGFNCDFWGP-UHFFFAOYSA-N
MW148.23 g/mol
LogP-1.18
Rot. Bonds4

About (3-ethoxysilyloxiran-2-yl)methanol

(3-ethoxysilyloxiran-2-yl)methanol (PubChem CID 174908758) has the molecular formula C5H12O3Si and a molecular weight of 148.23 g/mol. Its IUPAC name is (3-ethoxysilyloxiran-2-yl)methanol.

Molecular Properties

Compound Name(3-ethoxysilyloxiran-2-yl)methanol
PubChem CID174908758
Molecular FormulaC5H12O3Si
Molecular Weight148.23 g/mol
Exact Mass148.06
IUPAC Name(3-ethoxysilyloxiran-2-yl)methanol
SMILESCCO[SiH2]C1OC1CO
InChIInChI=1S/C5H12O3Si/c1-2-7-9-5-4(3-6)8-5/h4-6H,2-3,9H2,1H3
InChIKeyGBCNNGFNCDFWGP-UHFFFAOYSA-N
XLogP-1.18
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.23
LogP ≤ 5-1.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (3-ethoxysilyloxiran-2-yl)methanol?
The IUPAC name of (3-ethoxysilyloxiran-2-yl)methanol (CID 174908758) is (3-ethoxysilyloxiran-2-yl)methanol.
What is the SMILES notation for (3-ethoxysilyloxiran-2-yl)methanol?
The canonical SMILES for (3-ethoxysilyloxiran-2-yl)methanol is CCO[SiH2]C1OC1CO.
What is the InChIKey of (3-ethoxysilyloxiran-2-yl)methanol?
The InChIKey is GBCNNGFNCDFWGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12O3Si/c1-2-7-9-5-4(3-6)8-5/h4-6H,2-3,9H2,1H3.
What are the key properties of (3-ethoxysilyloxiran-2-yl)methanol?
(3-ethoxysilyloxiran-2-yl)methanol has a molecular weight of 148.23 g/mol, XLogP of -1.18, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethoxysilyloxiran-2-yl)methanol is sourced from PubChem (CID 174908758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).