CID 90118404

C13H15OSi — CID 90118404

IUPAC—
SMILESCCO[Si](C)c1cccc2ccccc12
InChIInChI=1S/C13H15OSi/c1-3-14-15(2)13-10-6-8-11-7-4-5-9-12(11)13/h4-10H,3H2,1-2H3
InChIKeyMVECIMVNXPAYIF-UHFFFAOYSA-N
MW215.35 g/mol
LogP2.70
Rot. Bonds3

About CID 90118404

CID 90118404 (PubChem CID 90118404) has the molecular formula C13H15OSi and a molecular weight of 215.35 g/mol.

Molecular Properties

Compound NameCID 90118404
PubChem CID90118404
Molecular FormulaC13H15OSi
Molecular Weight215.35 g/mol
Exact Mass215.09
IUPAC Name—
SMILESCCO[Si](C)c1cccc2ccccc12
InChIInChI=1S/C13H15OSi/c1-3-14-15(2)13-10-6-8-11-7-4-5-9-12(11)13/h4-10H,3H2,1-2H3
InChIKeyMVECIMVNXPAYIF-UHFFFAOYSA-N
XLogP2.70
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.35
LogP ≤ 52.70
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 90118404?
The IUPAC name of CID 90118404 (CID 90118404) is not available.
What is the SMILES notation for CID 90118404?
The canonical SMILES for CID 90118404 is CCO[Si](C)c1cccc2ccccc12.
What is the InChIKey of CID 90118404?
The InChIKey is MVECIMVNXPAYIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15OSi/c1-3-14-15(2)13-10-6-8-11-7-4-5-9-12(11)13/h4-10H,3H2,1-2H3.
What are the key properties of CID 90118404?
CID 90118404 has a molecular weight of 215.35 g/mol, XLogP of 2.70, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 90118404 is sourced from PubChem (CID 90118404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).