CID 136862862

C24H21O4Si2 — CID 136862862

IUPAC—
SMILESCOC(=O)/C([Si]c1ccccc1)=C(\C(=O)OC)[Si](c1ccccc1)c1ccccc1
InChIInChI=1S/C24H21O4Si2/c1-27-23(25)21(29-18-12-6-3-7-13-18)22(24(26)28-2)30(19-14-8-4-9-15-19)20-16-10-5-11-17-20/h3-17H,1-2H3/b22-21-
InChIKeyGLBDXGKBHORKCY-DQRAZIAOSA-N
MW429.60 g/mol
LogP1.46
Rot. Bonds7

About CID 136862862

CID 136862862 (PubChem CID 136862862) has the molecular formula C24H21O4Si2 and a molecular weight of 429.60 g/mol.

Molecular Properties

Compound NameCID 136862862
PubChem CID136862862
Molecular FormulaC24H21O4Si2
Molecular Weight429.60 g/mol
Exact Mass429.10
IUPAC Name—
SMILESCOC(=O)/C([Si]c1ccccc1)=C(\C(=O)OC)[Si](c1ccccc1)c1ccccc1
InChIInChI=1S/C24H21O4Si2/c1-27-23(25)21(29-18-12-6-3-7-13-18)22(24(26)28-2)30(19-14-8-4-9-15-19)20-16-10-5-11-17-20/h3-17H,1-2H3/b22-21-
InChIKeyGLBDXGKBHORKCY-DQRAZIAOSA-N
XLogP1.46
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500429.60
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 136862862?
The IUPAC name of CID 136862862 (CID 136862862) is not available.
What is the SMILES notation for CID 136862862?
The canonical SMILES for CID 136862862 is COC(=O)/C([Si]c1ccccc1)=C(\C(=O)OC)[Si](c1ccccc1)c1ccccc1.
What is the InChIKey of CID 136862862?
The InChIKey is GLBDXGKBHORKCY-DQRAZIAOSA-N. The full InChI is InChI=1S/C24H21O4Si2/c1-27-23(25)21(29-18-12-6-3-7-13-18)22(24(26)28-2)30(19-14-8-4-9-15-19)20-16-10-5-11-17-20/h3-17H,1-2H3/b22-21-.
What are the key properties of CID 136862862?
CID 136862862 has a molecular weight of 429.60 g/mol, XLogP of 1.46, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 136862862 is sourced from PubChem (CID 136862862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).