dihydroxy(oxo)silane;methyl 2-[1-(oxiran-2-ylmethyl)cyclopropyl]prop-2-enoate

C10H16O6Si — CID 88745082

IUPACdihydroxy(oxo)silane;methyl 2-[1-(oxiran-2-ylmethyl)cyclopropyl]prop-2-enoate
SMILESC=C(C(=O)OC)C1(CC2CO2)CC1.O=[Si](O)O
InChIInChI=1S/C10H14O3.H2O3Si/c1-7(9(11)12-2)10(3-4-10)5-8-6-13-8;1-4(2)3/h8H,1,3-6H2,2H3;1-2H
InChIKeyONVBVXDSQCOTGK-UHFFFAOYSA-N
MW260.32 g/mol
LogP-0.33
Rot. Bonds4

About dihydroxy(oxo)silane;methyl 2-[1-(oxiran-2-ylmethyl)cyclopropyl]prop-2-enoate

dihydroxy(oxo)silane;methyl 2-[1-(oxiran-2-ylmethyl)cyclopropyl]prop-2-enoate (PubChem CID 88745082) has the molecular formula C10H16O6Si and a molecular weight of 260.32 g/mol. Its IUPAC name is dihydroxy(oxo)silane;methyl 2-[1-(oxiran-2-ylmethyl)cyclopropyl]prop-2-enoate.

Molecular Properties

Compound Namedihydroxy(oxo)silane;methyl 2-[1-(oxiran-2-ylmethyl)cyclopropyl]prop-2-enoate
PubChem CID88745082
Molecular FormulaC10H16O6Si
Molecular Weight260.32 g/mol
Exact Mass260.07
IUPAC Namedihydroxy(oxo)silane;methyl 2-[1-(oxiran-2-ylmethyl)cyclopropyl]prop-2-enoate
SMILESC=C(C(=O)OC)C1(CC2CO2)CC1.O=[Si](O)O
InChIInChI=1S/C10H14O3.H2O3Si/c1-7(9(11)12-2)10(3-4-10)5-8-6-13-8;1-4(2)3/h8H,1,3-6H2,2H3;1-2H
InChIKeyONVBVXDSQCOTGK-UHFFFAOYSA-N
XLogP-0.33
TPSA96.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.32
LogP ≤ 5-0.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of dihydroxy(oxo)silane;methyl 2-[1-(oxiran-2-ylmethyl)cyclopropyl]prop-2-enoate?
The IUPAC name of dihydroxy(oxo)silane;methyl 2-[1-(oxiran-2-ylmethyl)cyclopropyl]prop-2-enoate (CID 88745082) is dihydroxy(oxo)silane;methyl 2-[1-(oxiran-2-ylmethyl)cyclopropyl]prop-2-enoate.
What is the SMILES notation for dihydroxy(oxo)silane;methyl 2-[1-(oxiran-2-ylmethyl)cyclopropyl]prop-2-enoate?
The canonical SMILES for dihydroxy(oxo)silane;methyl 2-[1-(oxiran-2-ylmethyl)cyclopropyl]prop-2-enoate is C=C(C(=O)OC)C1(CC2CO2)CC1.O=[Si](O)O.
What is the InChIKey of dihydroxy(oxo)silane;methyl 2-[1-(oxiran-2-ylmethyl)cyclopropyl]prop-2-enoate?
The InChIKey is ONVBVXDSQCOTGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O3.H2O3Si/c1-7(9(11)12-2)10(3-4-10)5-8-6-13-8;1-4(2)3/h8H,1,3-6H2,2H3;1-2H.
What are the key properties of dihydroxy(oxo)silane;methyl 2-[1-(oxiran-2-ylmethyl)cyclopropyl]prop-2-enoate?
dihydroxy(oxo)silane;methyl 2-[1-(oxiran-2-ylmethyl)cyclopropyl]prop-2-enoate has a molecular weight of 260.32 g/mol, XLogP of -0.33, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for dihydroxy(oxo)silane;methyl 2-[1-(oxiran-2-ylmethyl)cyclopropyl]prop-2-enoate is sourced from PubChem (CID 88745082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).