ethane;silicic acid

C8H36O12Si3 — CID 175605236

IUPACethane;silicic acid
SMILESCC.CC.CC.CC.O[Si](O)(O)O.O[Si](O)(O)O.O[Si](O)(O)O
InChIInChI=1S/4C2H6.3H4O4Si/c4*1-2;3*1-5(2,3)4/h4*1-2H3;3*1-4H
InChIKeyBWKNBWXEOBJKLY-UHFFFAOYSA-N
MW408.62 g/mol
LogP-3.72
Rot. Bonds

About ethane;silicic acid

ethane;silicic acid (PubChem CID 175605236) has the molecular formula C8H36O12Si3 and a molecular weight of 408.62 g/mol. Its IUPAC name is ethane;silicic acid.

Molecular Properties

Compound Nameethane;silicic acid
PubChem CID175605236
Molecular FormulaC8H36O12Si3
Molecular Weight408.62 g/mol
Exact Mass408.15
IUPAC Nameethane;silicic acid
SMILESCC.CC.CC.CC.O[Si](O)(O)O.O[Si](O)(O)O.O[Si](O)(O)O
InChIInChI=1S/4C2H6.3H4O4Si/c4*1-2;3*1-5(2,3)4/h4*1-2H3;3*1-4H
InChIKeyBWKNBWXEOBJKLY-UHFFFAOYSA-N
XLogP-3.72
TPSA242.76 Ų
H-Bond Donors12
H-Bond Acceptors12
Rotatable Bonds
Heavy Atoms23
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500408.62
LogP ≤ 5-3.72
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

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

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Related Compounds

silicic acid
CID 14942
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CID 87568735
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CID 172700350
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bis(lead(2+));silicic acid
CID 162344858
phosphane;silicic acid
CID 172771782
promethium;silicic acid
CID 173081948
silicic acid;vanadium
CID 175540804
propane;silicic acid
CID 88762660
silicic acid;tetramethylazanium
CID 158454802
methanol;silicic acid;trimethylalumane
CID 175081494
dipotassium;oxygen(2-);silicic acid
CID 162164078

Frequently Asked Questions

What is the IUPAC name of ethane;silicic acid?
The IUPAC name of ethane;silicic acid (CID 175605236) is ethane;silicic acid.
What is the SMILES notation for ethane;silicic acid?
The canonical SMILES for ethane;silicic acid is CC.CC.CC.CC.O[Si](O)(O)O.O[Si](O)(O)O.O[Si](O)(O)O.
What is the InChIKey of ethane;silicic acid?
The InChIKey is BWKNBWXEOBJKLY-UHFFFAOYSA-N. The full InChI is InChI=1S/4C2H6.3H4O4Si/c4*1-2;3*1-5(2,3)4/h4*1-2H3;3*1-4H.
What are the key properties of ethane;silicic acid?
ethane;silicic acid has a molecular weight of 408.62 g/mol, XLogP of -3.72, 0 rotatable bonds, 12 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;silicic acid is sourced from PubChem (CID 175605236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).