carboxy trimethylsilyl carbonate

C5H10O5Si — CID 91304270

IUPACcarboxy trimethylsilyl carbonate
SMILESC[Si](C)(C)OC(=O)OC(=O)O
InChIInChI=1S/C5H10O5Si/c1-11(2,3)10-5(8)9-4(6)7/h1-3H3,(H,6,7)
InChIKeyHQEVCMQIQPNGCM-UHFFFAOYSA-N
MW178.22 g/mol
LogP1.65
Rot. Bonds1

About carboxy trimethylsilyl carbonate

carboxy trimethylsilyl carbonate (PubChem CID 91304270) has the molecular formula C5H10O5Si and a molecular weight of 178.22 g/mol. Its IUPAC name is carboxy trimethylsilyl carbonate.

Molecular Properties

Compound Namecarboxy trimethylsilyl carbonate
PubChem CID91304270
Molecular FormulaC5H10O5Si
Molecular Weight178.22 g/mol
Exact Mass178.03
IUPAC Namecarboxy trimethylsilyl carbonate
SMILESC[Si](C)(C)OC(=O)OC(=O)O
InChIInChI=1S/C5H10O5Si/c1-11(2,3)10-5(8)9-4(6)7/h1-3H3,(H,6,7)
InChIKeyHQEVCMQIQPNGCM-UHFFFAOYSA-N
XLogP1.65
TPSA72.83 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.22
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of carboxy trimethylsilyl carbonate?
The IUPAC name of carboxy trimethylsilyl carbonate (CID 91304270) is carboxy trimethylsilyl carbonate.
What is the SMILES notation for carboxy trimethylsilyl carbonate?
The canonical SMILES for carboxy trimethylsilyl carbonate is C[Si](C)(C)OC(=O)OC(=O)O.
What is the InChIKey of carboxy trimethylsilyl carbonate?
The InChIKey is HQEVCMQIQPNGCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10O5Si/c1-11(2,3)10-5(8)9-4(6)7/h1-3H3,(H,6,7).
What are the key properties of carboxy trimethylsilyl carbonate?
carboxy trimethylsilyl carbonate has a molecular weight of 178.22 g/mol, XLogP of 1.65, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for carboxy trimethylsilyl carbonate is sourced from PubChem (CID 91304270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).