CID 136670518

C22H24S2Si2 — CID 136670518

IUPAC—
SMILESC[Si](C)/C=C/c1ccc(-c2ccc(-c3ccc(/C=C/[Si](C)C)s3)cc2)s1
InChIInChI=1S/C22H24S2Si2/c1-25(2)15-13-19-9-11-21(23-19)17-5-7-18(8-6-17)22-12-10-20(24-22)14-16-26(3)4/h5-16H,1-4H3/b15-13+,16-14+
InChIKeyHVYPELAMHJAHJK-WXUKJITCSA-N
MW408.74 g/mol
LogP7.76
Rot. Bonds6

About CID 136670518

CID 136670518 (PubChem CID 136670518) has the molecular formula C22H24S2Si2 and a molecular weight of 408.74 g/mol.

Molecular Properties

Compound NameCID 136670518
PubChem CID136670518
Molecular FormulaC22H24S2Si2
Molecular Weight408.74 g/mol
Exact Mass408.09
IUPAC Name—
SMILESC[Si](C)/C=C/c1ccc(-c2ccc(-c3ccc(/C=C/[Si](C)C)s3)cc2)s1
InChIInChI=1S/C22H24S2Si2/c1-25(2)15-13-19-9-11-21(23-19)17-5-7-18(8-6-17)22-12-10-20(24-22)14-16-26(3)4/h5-16H,1-4H3/b15-13+,16-14+
InChIKeyHVYPELAMHJAHJK-WXUKJITCSA-N
XLogP7.76
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500408.74
LogP ≤ 57.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 136670518?
The IUPAC name of CID 136670518 (CID 136670518) is not available.
What is the SMILES notation for CID 136670518?
The canonical SMILES for CID 136670518 is C[Si](C)/C=C/c1ccc(-c2ccc(-c3ccc(/C=C/[Si](C)C)s3)cc2)s1.
What is the InChIKey of CID 136670518?
The InChIKey is HVYPELAMHJAHJK-WXUKJITCSA-N. The full InChI is InChI=1S/C22H24S2Si2/c1-25(2)15-13-19-9-11-21(23-19)17-5-7-18(8-6-17)22-12-10-20(24-22)14-16-26(3)4/h5-16H,1-4H3/b15-13+,16-14+.
What are the key properties of CID 136670518?
CID 136670518 has a molecular weight of 408.74 g/mol, XLogP of 7.76, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 136670518 is sourced from PubChem (CID 136670518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).