methyl 2-methyl-2-trimethylsilyloxycyclopropane-1-carboxylate

C9H18O3Si — CID 12951415

IUPACmethyl 2-methyl-2-trimethylsilyloxycyclopropane-1-carboxylate
SMILESCOC(=O)C1CC1(C)O[Si](C)(C)C
InChIInChI=1S/C9H18O3Si/c1-9(12-13(3,4)5)6-7(9)8(10)11-2/h7H,6H2,1-5H3
InChIKeyDUWMKAXFMSBNLZ-UHFFFAOYSA-N
MW202.33 g/mol
LogP1.79
Rot. Bonds3

About methyl 2-methyl-2-trimethylsilyloxycyclopropane-1-carboxylate

methyl 2-methyl-2-trimethylsilyloxycyclopropane-1-carboxylate (PubChem CID 12951415) has the molecular formula C9H18O3Si and a molecular weight of 202.33 g/mol. Its IUPAC name is methyl 2-methyl-2-trimethylsilyloxycyclopropane-1-carboxylate.

Molecular Properties

Compound Namemethyl 2-methyl-2-trimethylsilyloxycyclopropane-1-carboxylate
PubChem CID12951415
Molecular FormulaC9H18O3Si
Molecular Weight202.33 g/mol
Exact Mass202.10
IUPAC Namemethyl 2-methyl-2-trimethylsilyloxycyclopropane-1-carboxylate
SMILESCOC(=O)C1CC1(C)O[Si](C)(C)C
InChIInChI=1S/C9H18O3Si/c1-9(12-13(3,4)5)6-7(9)8(10)11-2/h7H,6H2,1-5H3
InChIKeyDUWMKAXFMSBNLZ-UHFFFAOYSA-N
XLogP1.79
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.33
LogP ≤ 51.79
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

methyl 2-methoxy-3,3-dimethyl-2-trimethylsilyloxycyclobutane-1-carboxylate
CID 10923286
methyl 2-tert-butyl-2-trimethylsilyloxycyclopropane-1-carboxylate
CID 12647169
methyl 2-(2,3,4,5,6-pentafluorophenyl)-2-trimethylsilyloxycyclopropane-1-carboxylate
CID 102102674
dimethyl 1-methylcyclopropane-1,2-dicarboxylate
CID 574541
trans-methyl (1S,2R)-2-ethyl-2-methylcyclopropane-1-carboxylate
CID 129452445
methyl spiro[2.6]nonane-2-carboxylate
CID 144510342
trans-methyl (1S,2S)-2-ethenyl-2-methylcyclopropane-1-carboxylate
CID 10909650
cis-methyl (1S,2S)-2-ethynyl-2-methylcyclopropane-1-carboxylate
CID 12696061
methyl (2S)-2-[tert-butyl(dimethyl)silyl]oxy-3,3-dimethyl-2-propan-2-ylcyclobutane-1-carboxylate
CID 140523837
cis-methyl (1R,2S)-2-(1-fluoroethenyl)-2-methylcyclopropane-1-carboxylate
CID 11435080
methyl 3-methoxy-2,2,3-trimethylcyclopentane-1-carboxylate
CID 58476988
cis-methyl (1S,2S)-2-fluoro-2-(1-methylcyclopropyl)cyclopropane-1-carboxylate
CID 11298222

Frequently Asked Questions

What is the IUPAC name of methyl 2-methyl-2-trimethylsilyloxycyclopropane-1-carboxylate?
The IUPAC name of methyl 2-methyl-2-trimethylsilyloxycyclopropane-1-carboxylate (CID 12951415) is methyl 2-methyl-2-trimethylsilyloxycyclopropane-1-carboxylate.
What is the SMILES notation for methyl 2-methyl-2-trimethylsilyloxycyclopropane-1-carboxylate?
The canonical SMILES for methyl 2-methyl-2-trimethylsilyloxycyclopropane-1-carboxylate is COC(=O)C1CC1(C)O[Si](C)(C)C.
What is the InChIKey of methyl 2-methyl-2-trimethylsilyloxycyclopropane-1-carboxylate?
The InChIKey is DUWMKAXFMSBNLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18O3Si/c1-9(12-13(3,4)5)6-7(9)8(10)11-2/h7H,6H2,1-5H3.
What are the key properties of methyl 2-methyl-2-trimethylsilyloxycyclopropane-1-carboxylate?
methyl 2-methyl-2-trimethylsilyloxycyclopropane-1-carboxylate has a molecular weight of 202.33 g/mol, XLogP of 1.79, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-methyl-2-trimethylsilyloxycyclopropane-1-carboxylate is sourced from PubChem (CID 12951415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).