CID 11333193

C9H19OSSi — CID 11333193

IUPAC—
SMILESC/C=C(\O[Si](C)C)SC(C)(C)C
InChIInChI=1S/C9H19OSSi/c1-7-8(10-12(5)6)11-9(2,3)4/h7H,1-6H3/b8-7+
InChIKeyPLUHLOJJSDUNDZ-BQYQJAHWSA-N
MW203.40 g/mol
LogP3.65
Rot. Bonds3

About CID 11333193

CID 11333193 (PubChem CID 11333193) has the molecular formula C9H19OSSi and a molecular weight of 203.40 g/mol.

Molecular Properties

Compound NameCID 11333193
PubChem CID11333193
Molecular FormulaC9H19OSSi
Molecular Weight203.40 g/mol
Exact Mass203.09
IUPAC Name—
SMILESC/C=C(\O[Si](C)C)SC(C)(C)C
InChIInChI=1S/C9H19OSSi/c1-7-8(10-12(5)6)11-9(2,3)4/h7H,1-6H3/b8-7+
InChIKeyPLUHLOJJSDUNDZ-BQYQJAHWSA-N
XLogP3.65
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.40
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 11333193?
The IUPAC name of CID 11333193 (CID 11333193) is not available.
What is the SMILES notation for CID 11333193?
The canonical SMILES for CID 11333193 is C/C=C(\O[Si](C)C)SC(C)(C)C.
What is the InChIKey of CID 11333193?
The InChIKey is PLUHLOJJSDUNDZ-BQYQJAHWSA-N. The full InChI is InChI=1S/C9H19OSSi/c1-7-8(10-12(5)6)11-9(2,3)4/h7H,1-6H3/b8-7+.
What are the key properties of CID 11333193?
CID 11333193 has a molecular weight of 203.40 g/mol, XLogP of 3.65, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 11333193 is sourced from PubChem (CID 11333193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).