trihydroxy(prop-2-enoxy)silane

C6H16O8Si2 — CID 87688044

IUPACtrihydroxy(prop-2-enoxy)silane
SMILESC=CCO[Si](O)(O)O.C=CCO[Si](O)(O)O
InChIInChI=1S/2C3H8O4Si/c2*1-2-3-7-8(4,5)6/h2*2,4-6H,1,3H2
InChIKeyXPLZSRFVWBVZQP-UHFFFAOYSA-N
MW272.36 g/mol
LogP-2.80
Rot. Bonds6

About trihydroxy(prop-2-enoxy)silane

trihydroxy(prop-2-enoxy)silane (PubChem CID 87688044) has the molecular formula C6H16O8Si2 and a molecular weight of 272.36 g/mol. Its IUPAC name is trihydroxy(prop-2-enoxy)silane.

Molecular Properties

Compound Nametrihydroxy(prop-2-enoxy)silane
PubChem CID87688044
Molecular FormulaC6H16O8Si2
Molecular Weight272.36 g/mol
Exact Mass272.04
IUPAC Nametrihydroxy(prop-2-enoxy)silane
SMILESC=CCO[Si](O)(O)O.C=CCO[Si](O)(O)O
InChIInChI=1S/2C3H8O4Si/c2*1-2-3-7-8(4,5)6/h2*2,4-6H,1,3H2
InChIKeyXPLZSRFVWBVZQP-UHFFFAOYSA-N
XLogP-2.80
TPSA139.84 Ų
H-Bond Donors6
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500272.36
LogP ≤ 5-2.80
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trihydroxy(prop-2-enoxy)silane?
The IUPAC name of trihydroxy(prop-2-enoxy)silane (CID 87688044) is trihydroxy(prop-2-enoxy)silane.
What is the SMILES notation for trihydroxy(prop-2-enoxy)silane?
The canonical SMILES for trihydroxy(prop-2-enoxy)silane is C=CCO[Si](O)(O)O.C=CCO[Si](O)(O)O.
What is the InChIKey of trihydroxy(prop-2-enoxy)silane?
The InChIKey is XPLZSRFVWBVZQP-UHFFFAOYSA-N. The full InChI is InChI=1S/2C3H8O4Si/c2*1-2-3-7-8(4,5)6/h2*2,4-6H,1,3H2.
What are the key properties of trihydroxy(prop-2-enoxy)silane?
trihydroxy(prop-2-enoxy)silane has a molecular weight of 272.36 g/mol, XLogP of -2.80, 6 rotatable bonds, 6 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for trihydroxy(prop-2-enoxy)silane is sourced from PubChem (CID 87688044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).