trimethylsilyl 1-trimethylsilyloxycyclopropane-1-carboxylate

C10H22O3Si2 — CID 13124370

IUPACtrimethylsilyl 1-trimethylsilyloxycyclopropane-1-carboxylate
SMILESC[Si](C)(C)OC(=O)C1(O[Si](C)(C)C)CC1
InChIInChI=1S/C10H22O3Si2/c1-14(2,3)12-9(11)10(7-8-10)13-15(4,5)6/h7-8H2,1-6H3
InChIKeyHGTNMUVJEVREFH-UHFFFAOYSA-N
MW246.45 g/mol
LogP2.75
Rot. Bonds4

About trimethylsilyl 1-trimethylsilyloxycyclopropane-1-carboxylate

trimethylsilyl 1-trimethylsilyloxycyclopropane-1-carboxylate (PubChem CID 13124370) has the molecular formula C10H22O3Si2 and a molecular weight of 246.45 g/mol. Its IUPAC name is trimethylsilyl 1-trimethylsilyloxycyclopropane-1-carboxylate.

Molecular Properties

Compound Nametrimethylsilyl 1-trimethylsilyloxycyclopropane-1-carboxylate
PubChem CID13124370
Molecular FormulaC10H22O3Si2
Molecular Weight246.45 g/mol
Exact Mass246.11
IUPAC Nametrimethylsilyl 1-trimethylsilyloxycyclopropane-1-carboxylate
SMILESC[Si](C)(C)OC(=O)C1(O[Si](C)(C)C)CC1
InChIInChI=1S/C10H22O3Si2/c1-14(2,3)12-9(11)10(7-8-10)13-15(4,5)6/h7-8H2,1-6H3
InChIKeyHGTNMUVJEVREFH-UHFFFAOYSA-N
XLogP2.75
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.45
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Propanoic acid, 2-methyl-2-[(trimethylsilyl)oxy]-, trimethylsilyl ester
CID 521575
Butanoic acid, 2-methyl-2-[(trimethylsilyl)oxy]-, trimethylsilyl ester
CID 553016
2-Hydroxy-2-methylbutyric acid, TBDMS
CID 91752565
Trimethylsilyl 2-methyl-1-trimethylsilyloxycyclopropane-1-carboxylate
CID 13124375
(R)-ethyl 2-((tert-butyldimethylsilyl)oxy)propanoate
CID 14778628
1-(Triisopropylsilyloxy)cyclopropylcarboxylic Acid Methyl Ester
CID 15480705
CID 18338446
CID 18338446
1-[Tert-butyl(dimethyl)silyl]oxycyclopropane-1-carboxylic acid
CID 67535348
1-Trimethylsiloxy-cyclopropanecarboxylate
CID 131712897
2-Methyl-3-trimethylsilyl-2-trimethylsilyloxybutanoate
CID 22214250

Frequently Asked Questions

What is the IUPAC name of trimethylsilyl 1-trimethylsilyloxycyclopropane-1-carboxylate?
The IUPAC name of trimethylsilyl 1-trimethylsilyloxycyclopropane-1-carboxylate (CID 13124370) is trimethylsilyl 1-trimethylsilyloxycyclopropane-1-carboxylate.
What is the SMILES notation for trimethylsilyl 1-trimethylsilyloxycyclopropane-1-carboxylate?
The canonical SMILES for trimethylsilyl 1-trimethylsilyloxycyclopropane-1-carboxylate is C[Si](C)(C)OC(=O)C1(O[Si](C)(C)C)CC1.
What is the InChIKey of trimethylsilyl 1-trimethylsilyloxycyclopropane-1-carboxylate?
The InChIKey is HGTNMUVJEVREFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O3Si2/c1-14(2,3)12-9(11)10(7-8-10)13-15(4,5)6/h7-8H2,1-6H3.
What are the key properties of trimethylsilyl 1-trimethylsilyloxycyclopropane-1-carboxylate?
trimethylsilyl 1-trimethylsilyloxycyclopropane-1-carboxylate has a molecular weight of 246.45 g/mol, XLogP of 2.75, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethylsilyl 1-trimethylsilyloxycyclopropane-1-carboxylate is sourced from PubChem (CID 13124370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).