CID 170637657

C11H21O5Si — CID 170637657

IUPAC—
SMILESCCOC[Si](C)C(CC)OCC1COC(=O)O1
InChIInChI=1S/C11H21O5Si/c1-4-10(17(3)8-13-5-2)14-6-9-7-15-11(12)16-9/h9-10H,4-8H2,1-3H3
InChIKeyROLGHQPUOURCMD-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.56
Rot. Bonds8

About CID 170637657

CID 170637657 (PubChem CID 170637657) has the molecular formula C11H21O5Si and a molecular weight of 261.37 g/mol.

Molecular Properties

Compound NameCID 170637657
PubChem CID170637657
Molecular FormulaC11H21O5Si
Molecular Weight261.37 g/mol
Exact Mass261.12
IUPAC Name—
SMILESCCOC[Si](C)C(CC)OCC1COC(=O)O1
InChIInChI=1S/C11H21O5Si/c1-4-10(17(3)8-13-5-2)14-6-9-7-15-11(12)16-9/h9-10H,4-8H2,1-3H3
InChIKeyROLGHQPUOURCMD-UHFFFAOYSA-N
XLogP1.56
TPSA53.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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 170637657?
The IUPAC name of CID 170637657 (CID 170637657) is not available.
What is the SMILES notation for CID 170637657?
The canonical SMILES for CID 170637657 is CCOC[Si](C)C(CC)OCC1COC(=O)O1.
What is the InChIKey of CID 170637657?
The InChIKey is ROLGHQPUOURCMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21O5Si/c1-4-10(17(3)8-13-5-2)14-6-9-7-15-11(12)16-9/h9-10H,4-8H2,1-3H3.
What are the key properties of CID 170637657?
CID 170637657 has a molecular weight of 261.37 g/mol, XLogP of 1.56, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for CID 170637657 is sourced from PubChem (CID 170637657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).