propan-2-ol;trihydroxy(prop-2-enoxy)silane

C6H16O5Si — CID 88506518

IUPACpropan-2-ol;trihydroxy(prop-2-enoxy)silane
SMILESC=CCO[Si](O)(O)O.CC(C)O
InChIInChI=1S/C3H8O4Si.C3H8O/c1-2-3-7-8(4,5)6;1-3(2)4/h2,4-6H,1,3H2;3-4H,1-2H3
InChIKeyAOXIGRXYPOSASU-UHFFFAOYSA-N
MW196.27 g/mol
LogP-1.01
Rot. Bonds3

About propan-2-ol;trihydroxy(prop-2-enoxy)silane

propan-2-ol;trihydroxy(prop-2-enoxy)silane (PubChem CID 88506518) has the molecular formula C6H16O5Si and a molecular weight of 196.27 g/mol. Its IUPAC name is propan-2-ol;trihydroxy(prop-2-enoxy)silane.

Molecular Properties

Compound Namepropan-2-ol;trihydroxy(prop-2-enoxy)silane
PubChem CID88506518
Molecular FormulaC6H16O5Si
Molecular Weight196.27 g/mol
Exact Mass196.08
IUPAC Namepropan-2-ol;trihydroxy(prop-2-enoxy)silane
SMILESC=CCO[Si](O)(O)O.CC(C)O
InChIInChI=1S/C3H8O4Si.C3H8O/c1-2-3-7-8(4,5)6;1-3(2)4/h2,4-6H,1,3H2;3-4H,1-2H3
InChIKeyAOXIGRXYPOSASU-UHFFFAOYSA-N
XLogP-1.01
TPSA90.15 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.27
LogP ≤ 5-1.01
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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 propan-2-ol;trihydroxy(prop-2-enoxy)silane?
The IUPAC name of propan-2-ol;trihydroxy(prop-2-enoxy)silane (CID 88506518) is propan-2-ol;trihydroxy(prop-2-enoxy)silane.
What is the SMILES notation for propan-2-ol;trihydroxy(prop-2-enoxy)silane?
The canonical SMILES for propan-2-ol;trihydroxy(prop-2-enoxy)silane is C=CCO[Si](O)(O)O.CC(C)O.
What is the InChIKey of propan-2-ol;trihydroxy(prop-2-enoxy)silane?
The InChIKey is AOXIGRXYPOSASU-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8O4Si.C3H8O/c1-2-3-7-8(4,5)6;1-3(2)4/h2,4-6H,1,3H2;3-4H,1-2H3.
What are the key properties of propan-2-ol;trihydroxy(prop-2-enoxy)silane?
propan-2-ol;trihydroxy(prop-2-enoxy)silane has a molecular weight of 196.27 g/mol, XLogP of -1.01, 3 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for propan-2-ol;trihydroxy(prop-2-enoxy)silane is sourced from PubChem (CID 88506518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).