CID 134964634

C9H22NO3Si2 — CID 134964634

IUPAC—
SMILESCCN(CC)CCC[Si](OC)(OC)O[Si]
InChIInChI=1S/C9H22NO3Si2/c1-5-10(6-2)8-7-9-15(11-3,12-4)13-14/h5-9H2,1-4H3
InChIKeyHKQHXVSLANMYCR-UHFFFAOYSA-N
MW248.45 g/mol
LogP1.05
Rot. Bonds9

About CID 134964634

CID 134964634 (PubChem CID 134964634) has the molecular formula C9H22NO3Si2 and a molecular weight of 248.45 g/mol.

Molecular Properties

Compound NameCID 134964634
PubChem CID134964634
Molecular FormulaC9H22NO3Si2
Molecular Weight248.45 g/mol
Exact Mass248.11
IUPAC Name—
SMILESCCN(CC)CCC[Si](OC)(OC)O[Si]
InChIInChI=1S/C9H22NO3Si2/c1-5-10(6-2)8-7-9-15(11-3,12-4)13-14/h5-9H2,1-4H3
InChIKeyHKQHXVSLANMYCR-UHFFFAOYSA-N
XLogP1.05
TPSA30.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.45
LogP ≤ 51.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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 134964634?
The IUPAC name of CID 134964634 (CID 134964634) is not available.
What is the SMILES notation for CID 134964634?
The canonical SMILES for CID 134964634 is CCN(CC)CCC[Si](OC)(OC)O[Si].
What is the InChIKey of CID 134964634?
The InChIKey is HKQHXVSLANMYCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22NO3Si2/c1-5-10(6-2)8-7-9-15(11-3,12-4)13-14/h5-9H2,1-4H3.
What are the key properties of CID 134964634?
CID 134964634 has a molecular weight of 248.45 g/mol, XLogP of 1.05, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 134964634 is sourced from PubChem (CID 134964634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).