CID 18709864

C13H21O4Si2 — CID 18709864

IUPAC—
SMILESC=[Si]OC(C)C/C=C/C=C/C(O[Si]C)C(C)C(=O)O
InChIInChI=1S/C13H21O4Si2/c1-10(16-18-3)8-6-5-7-9-12(17-19-4)11(2)13(14)15/h5-7,9-12H,3,8H2,1-2,4H3,(H,14,15)/b6-5+,9-7+
InChIKeyRAWOSXKGCFQRLB-SBIWHPGTSA-N
MW297.48 g/mol
LogP1.72
Rot. Bonds10

About CID 18709864

CID 18709864 (PubChem CID 18709864) has the molecular formula C13H21O4Si2 and a molecular weight of 297.48 g/mol.

Molecular Properties

Compound NameCID 18709864
PubChem CID18709864
Molecular FormulaC13H21O4Si2
Molecular Weight297.48 g/mol
Exact Mass297.10
IUPAC Name—
SMILESC=[Si]OC(C)C/C=C/C=C/C(O[Si]C)C(C)C(=O)O
InChIInChI=1S/C13H21O4Si2/c1-10(16-18-3)8-6-5-7-9-12(17-19-4)11(2)13(14)15/h5-7,9-12H,3,8H2,1-2,4H3,(H,14,15)/b6-5+,9-7+
InChIKeyRAWOSXKGCFQRLB-SBIWHPGTSA-N
XLogP1.72
TPSA55.76 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.48
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 18709864?
The IUPAC name of CID 18709864 (CID 18709864) is not available.
What is the SMILES notation for CID 18709864?
The canonical SMILES for CID 18709864 is C=[Si]OC(C)C/C=C/C=C/C(O[Si]C)C(C)C(=O)O.
What is the InChIKey of CID 18709864?
The InChIKey is RAWOSXKGCFQRLB-SBIWHPGTSA-N. The full InChI is InChI=1S/C13H21O4Si2/c1-10(16-18-3)8-6-5-7-9-12(17-19-4)11(2)13(14)15/h5-7,9-12H,3,8H2,1-2,4H3,(H,14,15)/b6-5+,9-7+.
What are the key properties of CID 18709864?
CID 18709864 has a molecular weight of 297.48 g/mol, XLogP of 1.72, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 18709864 is sourced from PubChem (CID 18709864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).