CID 66993192

C10H13OSi — CID 66993192

IUPAC—
SMILESCc1ccc(C(=O)[Si](C)C)cc1
InChIInChI=1S/C10H13OSi/c1-8-4-6-9(7-5-8)10(11)12(2)3/h4-7H,1-3H3
InChIKeyQTKKJIADXTYUFL-UHFFFAOYSA-N
MW177.30 g/mol
LogP2.47
Rot. Bonds2

About CID 66993192

CID 66993192 (PubChem CID 66993192) has the molecular formula C10H13OSi and a molecular weight of 177.30 g/mol.

Molecular Properties

Compound NameCID 66993192
PubChem CID66993192
Molecular FormulaC10H13OSi
Molecular Weight177.30 g/mol
Exact Mass177.07
IUPAC Name—
SMILESCc1ccc(C(=O)[Si](C)C)cc1
InChIInChI=1S/C10H13OSi/c1-8-4-6-9(7-5-8)10(11)12(2)3/h4-7H,1-3H3
InChIKeyQTKKJIADXTYUFL-UHFFFAOYSA-N
XLogP2.47
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.30
LogP ≤ 52.47
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 66993192?
The IUPAC name of CID 66993192 (CID 66993192) is not available.
What is the SMILES notation for CID 66993192?
The canonical SMILES for CID 66993192 is Cc1ccc(C(=O)[Si](C)C)cc1.
What is the InChIKey of CID 66993192?
The InChIKey is QTKKJIADXTYUFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13OSi/c1-8-4-6-9(7-5-8)10(11)12(2)3/h4-7H,1-3H3.
What are the key properties of CID 66993192?
CID 66993192 has a molecular weight of 177.30 g/mol, XLogP of 2.47, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 66993192 is sourced from PubChem (CID 66993192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).