CID 22913655

C24H37ClFSi — CID 22913655

IUPAC—
SMILESCCC[Si]1CCC(CCCCC2CCC(c3ccc(Cl)c(F)c3)CC2)CC1
InChIInChI=1S/C24H37ClFSi/c1-2-15-27-16-13-20(14-17-27)6-4-3-5-19-7-9-21(10-8-19)22-11-12-23(25)24(26)18-22/h11-12,18-21H,2-10,13-17H2,1H3
InChIKeyTWYXEHSWDIJBKI-UHFFFAOYSA-N
MW408.10 g/mol
LogP8.63
Rot. Bonds8

About CID 22913655

CID 22913655 (PubChem CID 22913655) has the molecular formula C24H37ClFSi and a molecular weight of 408.10 g/mol.

Molecular Properties

Compound NameCID 22913655
PubChem CID22913655
Molecular FormulaC24H37ClFSi
Molecular Weight408.10 g/mol
Exact Mass407.23
IUPAC Name—
SMILESCCC[Si]1CCC(CCCCC2CCC(c3ccc(Cl)c(F)c3)CC2)CC1
InChIInChI=1S/C24H37ClFSi/c1-2-15-27-16-13-20(14-17-27)6-4-3-5-19-7-9-21(10-8-19)22-11-12-23(25)24(26)18-22/h11-12,18-21H,2-10,13-17H2,1H3
InChIKeyTWYXEHSWDIJBKI-UHFFFAOYSA-N
XLogP8.63
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500408.10
LogP ≤ 58.63
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'}

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 22913655?
The IUPAC name of CID 22913655 (CID 22913655) is not available.
What is the SMILES notation for CID 22913655?
The canonical SMILES for CID 22913655 is CCC[Si]1CCC(CCCCC2CCC(c3ccc(Cl)c(F)c3)CC2)CC1.
What is the InChIKey of CID 22913655?
The InChIKey is TWYXEHSWDIJBKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H37ClFSi/c1-2-15-27-16-13-20(14-17-27)6-4-3-5-19-7-9-21(10-8-19)22-11-12-23(25)24(26)18-22/h11-12,18-21H,2-10,13-17H2,1H3.
What are the key properties of CID 22913655?
CID 22913655 has a molecular weight of 408.10 g/mol, XLogP of 8.63, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 22913655 is sourced from PubChem (CID 22913655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).