CID 136688381

C12H30N2O6Si+2 — CID 136688381

IUPAC—
SMILESCCO[N+](OCC)(OCC)[Si][N+](OCC)(OCC)OCC
InChIInChI=1S/C12H30N2O6Si/c1-7-15-13(16-8-2,17-9-3)21-14(18-10-4,19-11-5)20-12-6/h7-12H2,1-6H3/q+2
InChIKeyFUOHAEARPIGKQB-UHFFFAOYSA-N
MW326.47 g/mol
LogP1.86
Rot. Bonds14

About CID 136688381

CID 136688381 (PubChem CID 136688381) has the molecular formula C12H30N2O6Si+2 and a molecular weight of 326.47 g/mol.

Molecular Properties

Compound NameCID 136688381
PubChem CID136688381
Molecular FormulaC12H30N2O6Si+2
Molecular Weight326.47 g/mol
Exact Mass326.19
IUPAC Name—
SMILESCCO[N+](OCC)(OCC)[Si][N+](OCC)(OCC)OCC
InChIInChI=1S/C12H30N2O6Si/c1-7-15-13(16-8-2,17-9-3)21-14(18-10-4,19-11-5)20-12-6/h7-12H2,1-6H3/q+2
InChIKeyFUOHAEARPIGKQB-UHFFFAOYSA-N
XLogP1.86
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds14
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.47
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

amino-ethoxy-methoxy-methylazanium
CID 163831718
ethoxyethane;sulfane
CID 90240371
ethoxyethane;sulfane
CID 87243372
N-ethoxy-N-methylpropan-1-amine oxide
CID 175077084
butyl-ethoxy-dipropylazanium
CID 87333997
propane;ruthenium
CID 161061794
ethoxyethane
CID 18694919
ethoxyethane
CID 19002445
triethoxy(1,2,4-triazol-4-ylmethyl)silane
CID 67387818
sulfane;triethoxysilane
CID 173007277
[chloro(hydroxy)phosphanyl]-ethoxy-di(propan-2-yl)azanium
CID 87534494
ethoxyethane;pentahydrate
CID 141041283

Frequently Asked Questions

What is the IUPAC name of CID 136688381?
The IUPAC name of CID 136688381 (CID 136688381) is not available.
What is the SMILES notation for CID 136688381?
The canonical SMILES for CID 136688381 is CCO[N+](OCC)(OCC)[Si][N+](OCC)(OCC)OCC.
What is the InChIKey of CID 136688381?
The InChIKey is FUOHAEARPIGKQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H30N2O6Si/c1-7-15-13(16-8-2,17-9-3)21-14(18-10-4,19-11-5)20-12-6/h7-12H2,1-6H3/q+2.
What are the key properties of CID 136688381?
CID 136688381 has a molecular weight of 326.47 g/mol, XLogP of 1.86, 14 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for CID 136688381 is sourced from PubChem (CID 136688381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).