trimethylsilyl 2-ethyl-1-trimethylsilyloxycyclopropane-1-carboxylate

C12H26O3Si2 — CID 20515749

IUPACtrimethylsilyl 2-ethyl-1-trimethylsilyloxycyclopropane-1-carboxylate
SMILESCCC1CC1(O[Si](C)(C)C)C(=O)O[Si](C)(C)C
InChIInChI=1S/C12H26O3Si2/c1-8-10-9-12(10,15-17(5,6)7)11(13)14-16(2,3)4/h10H,8-9H2,1-7H3
InChIKeyBMHFKIKNICICIR-UHFFFAOYSA-N
MW274.51 g/mol
LogP3.38
Rot. Bonds5

About trimethylsilyl 2-ethyl-1-trimethylsilyloxycyclopropane-1-carboxylate

trimethylsilyl 2-ethyl-1-trimethylsilyloxycyclopropane-1-carboxylate (PubChem CID 20515749) has the molecular formula C12H26O3Si2 and a molecular weight of 274.51 g/mol. Its IUPAC name is trimethylsilyl 2-ethyl-1-trimethylsilyloxycyclopropane-1-carboxylate.

Molecular Properties

Compound Nametrimethylsilyl 2-ethyl-1-trimethylsilyloxycyclopropane-1-carboxylate
PubChem CID20515749
Molecular FormulaC12H26O3Si2
Molecular Weight274.51 g/mol
Exact Mass274.14
IUPAC Nametrimethylsilyl 2-ethyl-1-trimethylsilyloxycyclopropane-1-carboxylate
SMILESCCC1CC1(O[Si](C)(C)C)C(=O)O[Si](C)(C)C
InChIInChI=1S/C12H26O3Si2/c1-8-10-9-12(10,15-17(5,6)7)11(13)14-16(2,3)4/h10H,8-9H2,1-7H3
InChIKeyBMHFKIKNICICIR-UHFFFAOYSA-N
XLogP3.38
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.51
LogP ≤ 53.38
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

trimethylsilyl (3R,4S,5R)-1-trimethylsilyl-3,4,5-tris(trimethylsilyloxy)piperidine-3-carboxylate
CID 11353184
trimethylsilyl 2-(trimethylsilylamino)adamantane-2-carboxylate
CID 19421019
trimethylsilyl 2-isocyanato-1,2-dimethylcyclopropane-1-carboxylate
CID 22297803
1-[(1R,2S)-2-ethyl-1-methylcyclopropyl]ethanone
CID 89117681
ethyl 1-trimethylsilyloxycyclohexane-1-carboxylate
CID 141498306
ditert-butyl 2-ethylcyclobutane-1,1-dicarboxylate
CID 175257362
trimethylsilyl 4-methyltetracyclo[6.2.1.13,6.02,7]dodec-9-ene-4-carboxylate
CID 58879115
methyl (6S,7R)-2-oxo-7-trimethylsilyloxybicyclo[4.2.0]octane-7-carboxylate
CID 134974003
trimethylsilyl 2-oxopropanoate
CID 554459
(2S)-2-amino-2-[(1R,2R)-1-amino-2-ethylcyclopropyl]acetic acid
CID 11768839
methyl 2-methyl-2-trimethylsilyloxycyclopropane-1-carboxylate
CID 12951415
ethyl 1-trimethylsilyloxybicyclo[4.1.0]heptane-7-carboxylate
CID 73192843

Frequently Asked Questions

What is the IUPAC name of trimethylsilyl 2-ethyl-1-trimethylsilyloxycyclopropane-1-carboxylate?
The IUPAC name of trimethylsilyl 2-ethyl-1-trimethylsilyloxycyclopropane-1-carboxylate (CID 20515749) is trimethylsilyl 2-ethyl-1-trimethylsilyloxycyclopropane-1-carboxylate.
What is the SMILES notation for trimethylsilyl 2-ethyl-1-trimethylsilyloxycyclopropane-1-carboxylate?
The canonical SMILES for trimethylsilyl 2-ethyl-1-trimethylsilyloxycyclopropane-1-carboxylate is CCC1CC1(O[Si](C)(C)C)C(=O)O[Si](C)(C)C.
What is the InChIKey of trimethylsilyl 2-ethyl-1-trimethylsilyloxycyclopropane-1-carboxylate?
The InChIKey is BMHFKIKNICICIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26O3Si2/c1-8-10-9-12(10,15-17(5,6)7)11(13)14-16(2,3)4/h10H,8-9H2,1-7H3.
What are the key properties of trimethylsilyl 2-ethyl-1-trimethylsilyloxycyclopropane-1-carboxylate?
trimethylsilyl 2-ethyl-1-trimethylsilyloxycyclopropane-1-carboxylate has a molecular weight of 274.51 g/mol, XLogP of 3.38, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethylsilyl 2-ethyl-1-trimethylsilyloxycyclopropane-1-carboxylate is sourced from PubChem (CID 20515749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).