CID 22404164

C19H31Cl4Si2 — CID 22404164

IUPAC—
SMILESCCCCCC[Si](Cl)(Cl)C(C)(C)C(c1ccccc1)C(C)(C)[Si](Cl)Cl
InChIInChI=1S/C19H31Cl4Si2/c1-6-7-8-12-15-25(22,23)19(4,5)17(18(2,3)24(20)21)16-13-10-9-11-14-16/h9-11,13-14,17H,6-8,12,15H2,1-5H3
InChIKeyHHPROIMLQHUQMT-UHFFFAOYSA-N
MW457.44 g/mol
LogP8.80
Rot. Bonds10

About CID 22404164

CID 22404164 (PubChem CID 22404164) has the molecular formula C19H31Cl4Si2 and a molecular weight of 457.44 g/mol.

Molecular Properties

Compound NameCID 22404164
PubChem CID22404164
Molecular FormulaC19H31Cl4Si2
Molecular Weight457.44 g/mol
Exact Mass455.07
IUPAC Name—
SMILESCCCCCC[Si](Cl)(Cl)C(C)(C)C(c1ccccc1)C(C)(C)[Si](Cl)Cl
InChIInChI=1S/C19H31Cl4Si2/c1-6-7-8-12-15-25(22,23)19(4,5)17(18(2,3)24(20)21)16-13-10-9-11-14-16/h9-11,13-14,17H,6-8,12,15H2,1-5H3
InChIKeyHHPROIMLQHUQMT-UHFFFAOYSA-N
XLogP8.80
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500457.44
LogP ≤ 58.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 22404164?
The IUPAC name of CID 22404164 (CID 22404164) is not available.
What is the SMILES notation for CID 22404164?
The canonical SMILES for CID 22404164 is CCCCCC[Si](Cl)(Cl)C(C)(C)C(c1ccccc1)C(C)(C)[Si](Cl)Cl.
What is the InChIKey of CID 22404164?
The InChIKey is HHPROIMLQHUQMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H31Cl4Si2/c1-6-7-8-12-15-25(22,23)19(4,5)17(18(2,3)24(20)21)16-13-10-9-11-14-16/h9-11,13-14,17H,6-8,12,15H2,1-5H3.
What are the key properties of CID 22404164?
CID 22404164 has a molecular weight of 457.44 g/mol, XLogP of 8.80, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 22404164 is sourced from PubChem (CID 22404164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).