CID 19611913

C20H41O3SiV — CID 19611913

IUPAC—
SMILESCC(C)(C)[O-].CC(C)(C)[O-].CC(C)(C)[O-].C[Si](C)C.[C-]1=CC=CC1.[V+4]
InChIInChI=1S/C5H5.3C4H9O.C3H9Si.V/c1-2-4-5-3-1;3*1-4(2,3)5;1-4(2)3;/h1-3H,4H2;3*1-3H3;1-3H3;/q4*-1;;+4
InChIKeyQYBSAEQZMAWLST-UHFFFAOYSA-N
MW408.58 g/mol
LogP3.11
Rot. Bonds

About CID 19611913

CID 19611913 (PubChem CID 19611913) has the molecular formula C20H41O3SiV and a molecular weight of 408.58 g/mol.

Molecular Properties

Compound NameCID 19611913
PubChem CID19611913
Molecular FormulaC20H41O3SiV
Molecular Weight408.58 g/mol
Exact Mass408.23
IUPAC Name—
SMILESCC(C)(C)[O-].CC(C)(C)[O-].CC(C)(C)[O-].C[Si](C)C.[C-]1=CC=CC1.[V+4]
InChIInChI=1S/C5H5.3C4H9O.C3H9Si.V/c1-2-4-5-3-1;3*1-4(2,3)5;1-4(2)3;/h1-3H,4H2;3*1-3H3;1-3H3;/q4*-1;;+4
InChIKeyQYBSAEQZMAWLST-UHFFFAOYSA-N
XLogP3.11
TPSA69.18 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.58
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 19611913?
The IUPAC name of CID 19611913 (CID 19611913) is not available.
What is the SMILES notation for CID 19611913?
The canonical SMILES for CID 19611913 is CC(C)(C)[O-].CC(C)(C)[O-].CC(C)(C)[O-].C[Si](C)C.[C-]1=CC=CC1.[V+4].
What is the InChIKey of CID 19611913?
The InChIKey is QYBSAEQZMAWLST-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5.3C4H9O.C3H9Si.V/c1-2-4-5-3-1;3*1-4(2,3)5;1-4(2)3;/h1-3H,4H2;3*1-3H3;1-3H3;/q4*-1;;+4.
What are the key properties of CID 19611913?
CID 19611913 has a molecular weight of 408.58 g/mol, XLogP of 3.11, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 19611913 is sourced from PubChem (CID 19611913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).