CID 66991121

C12H17OSi — CID 66991121

IUPAC—
SMILESCC(C)c1ccccc1C(C)(C)O[Si]
InChIInChI=1S/C12H17OSi/c1-9(2)10-7-5-6-8-11(10)12(3,4)13-14/h5-9H,1-4H3
InChIKeyGNTMAHRYFXQJHF-UHFFFAOYSA-N
MW205.35 g/mol
LogP3.15
Rot. Bonds3

About CID 66991121

CID 66991121 (PubChem CID 66991121) has the molecular formula C12H17OSi and a molecular weight of 205.35 g/mol.

Molecular Properties

Compound NameCID 66991121
PubChem CID66991121
Molecular FormulaC12H17OSi
Molecular Weight205.35 g/mol
Exact Mass205.10
IUPAC Name—
SMILESCC(C)c1ccccc1C(C)(C)O[Si]
InChIInChI=1S/C12H17OSi/c1-9(2)10-7-5-6-8-11(10)12(3,4)13-14/h5-9H,1-4H3
InChIKeyGNTMAHRYFXQJHF-UHFFFAOYSA-N
XLogP3.15
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.35
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'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 66991121?
The IUPAC name of CID 66991121 (CID 66991121) is not available.
What is the SMILES notation for CID 66991121?
The canonical SMILES for CID 66991121 is CC(C)c1ccccc1C(C)(C)O[Si].
What is the InChIKey of CID 66991121?
The InChIKey is GNTMAHRYFXQJHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17OSi/c1-9(2)10-7-5-6-8-11(10)12(3,4)13-14/h5-9H,1-4H3.
What are the key properties of CID 66991121?
CID 66991121 has a molecular weight of 205.35 g/mol, XLogP of 3.15, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 66991121 is sourced from PubChem (CID 66991121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).