silyloxy hydrogen carbonate

CH4O4Si — CID 173188657

IUPACsilyloxy hydrogen carbonate
SMILESO=C(O)OO[SiH3]
InChIInChI=1S/CH4O4Si/c2-1(3)4-5-6/h6H3,(H,2,3)
InChIKeyHVOZQJDTTFGZJE-UHFFFAOYSA-N
MW108.12 g/mol
LogP-1.11
Rot. Bonds1

About silyloxy hydrogen carbonate

silyloxy hydrogen carbonate (PubChem CID 173188657) has the molecular formula CH4O4Si and a molecular weight of 108.12 g/mol. Its IUPAC name is silyloxy hydrogen carbonate.

Molecular Properties

Compound Namesilyloxy hydrogen carbonate
PubChem CID173188657
Molecular FormulaCH4O4Si
Molecular Weight108.12 g/mol
Exact Mass107.99
IUPAC Namesilyloxy hydrogen carbonate
SMILESO=C(O)OO[SiH3]
InChIInChI=1S/CH4O4Si/c2-1(3)4-5-6/h6H3,(H,2,3)
InChIKeyHVOZQJDTTFGZJE-UHFFFAOYSA-N
XLogP-1.11
TPSA55.76 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500108.12
LogP ≤ 5-1.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

carboxyoxy hydrogen carbonate;neodymium
CID 174688278
CID 87206652
CID 87206652
dicalcium;carboxyoxy hydrogen carbonate;hydride
CID 173048149
alumane;silyl hydrogen carbonate
CID 173231811
carboxyperoxy hydrogen carbonate;uranium
CID 90091510
aminooxy hydrogen carbonate
CID 141080921
methoxy hydrogen carbonate
CID 19018247
carbonic acid;ruthenium
CID 87059075
carboxyperoxy formate
CID 20570702
carbonoperoxoic acid;iron
CID 87244357
carboxy hydrogen carbonate;hydrochloride
CID 141485807
carbonic acid;carbonoperoxoic acid
CID 87881933

Frequently Asked Questions

What is the IUPAC name of silyloxy hydrogen carbonate?
The IUPAC name of silyloxy hydrogen carbonate (CID 173188657) is silyloxy hydrogen carbonate.
What is the SMILES notation for silyloxy hydrogen carbonate?
The canonical SMILES for silyloxy hydrogen carbonate is O=C(O)OO[SiH3].
What is the InChIKey of silyloxy hydrogen carbonate?
The InChIKey is HVOZQJDTTFGZJE-UHFFFAOYSA-N. The full InChI is InChI=1S/CH4O4Si/c2-1(3)4-5-6/h6H3,(H,2,3).
What are the key properties of silyloxy hydrogen carbonate?
silyloxy hydrogen carbonate has a molecular weight of 108.12 g/mol, XLogP of -1.11, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for silyloxy hydrogen carbonate is sourced from PubChem (CID 173188657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).