CID 137266763

C24H21OSi — CID 137266763

IUPAC—
SMILESCc1cc(C)cc(O[Si](c2ccccc2)c2cccc3ccccc23)c1
InChIInChI=1S/C24H21OSi/c1-18-15-19(2)17-21(16-18)25-26(22-11-4-3-5-12-22)24-14-8-10-20-9-6-7-13-23(20)24/h3-17H,1-2H3
InChIKeyUUIYTAFIGRTXHH-UHFFFAOYSA-N
MW353.52 g/mol
LogP4.64
Rot. Bonds4

About CID 137266763

CID 137266763 (PubChem CID 137266763) has the molecular formula C24H21OSi and a molecular weight of 353.52 g/mol.

Molecular Properties

Compound NameCID 137266763
PubChem CID137266763
Molecular FormulaC24H21OSi
Molecular Weight353.52 g/mol
Exact Mass353.14
IUPAC Name—
SMILESCc1cc(C)cc(O[Si](c2ccccc2)c2cccc3ccccc23)c1
InChIInChI=1S/C24H21OSi/c1-18-15-19(2)17-21(16-18)25-26(22-11-4-3-5-12-22)24-14-8-10-20-9-6-7-13-23(20)24/h3-17H,1-2H3
InChIKeyUUIYTAFIGRTXHH-UHFFFAOYSA-N
XLogP4.64
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.52
LogP ≤ 54.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 137266763?
The IUPAC name of CID 137266763 (CID 137266763) is not available.
What is the SMILES notation for CID 137266763?
The canonical SMILES for CID 137266763 is Cc1cc(C)cc(O[Si](c2ccccc2)c2cccc3ccccc23)c1.
What is the InChIKey of CID 137266763?
The InChIKey is UUIYTAFIGRTXHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21OSi/c1-18-15-19(2)17-21(16-18)25-26(22-11-4-3-5-12-22)24-14-8-10-20-9-6-7-13-23(20)24/h3-17H,1-2H3.
What are the key properties of CID 137266763?
CID 137266763 has a molecular weight of 353.52 g/mol, XLogP of 4.64, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 137266763 is sourced from PubChem (CID 137266763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).