methyl 2-ethenyl-1-trimethylsilylcyclopropane-1-carboxylate

C10H18O2Si — CID 10856457

IUPACmethyl 2-ethenyl-1-trimethylsilylcyclopropane-1-carboxylate
SMILESC=CC1CC1(C(=O)OC)[Si](C)(C)C
InChIInChI=1S/C10H18O2Si/c1-6-8-7-10(8,9(11)12-2)13(3,4)5/h6,8H,1,7H2,2-5H3
InChIKeyOMNFMTJRUWOVAP-UHFFFAOYSA-N
MW198.34 g/mol
LogP2.44
Rot. Bonds3

About methyl 2-ethenyl-1-trimethylsilylcyclopropane-1-carboxylate

methyl 2-ethenyl-1-trimethylsilylcyclopropane-1-carboxylate (PubChem CID 10856457) has the molecular formula C10H18O2Si and a molecular weight of 198.34 g/mol. Its IUPAC name is methyl 2-ethenyl-1-trimethylsilylcyclopropane-1-carboxylate.

Molecular Properties

Compound Namemethyl 2-ethenyl-1-trimethylsilylcyclopropane-1-carboxylate
PubChem CID10856457
Molecular FormulaC10H18O2Si
Molecular Weight198.34 g/mol
Exact Mass198.11
IUPAC Namemethyl 2-ethenyl-1-trimethylsilylcyclopropane-1-carboxylate
SMILESC=CC1CC1(C(=O)OC)[Si](C)(C)C
InChIInChI=1S/C10H18O2Si/c1-6-8-7-10(8,9(11)12-2)13(3,4)5/h6,8H,1,7H2,2-5H3
InChIKeyOMNFMTJRUWOVAP-UHFFFAOYSA-N
XLogP2.44
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.34
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

dimethyl 2-ethenylcyclopropane-1,1-dicarboxylate
CID 10464992
dimethyl 2-ethenylcyclopentane-1,1-dicarboxylate
CID 10703747
methane;methyl 2-ethenyl-1-(methoxyamino)cyclopropane-1-carboxylate
CID 143405073
methyl 2-ethenyl-1-(methoxycarbonylamino)cyclopropane-1-carboxylate
CID 73231611
trans-methyl (1S,2R)-2-phenyl-1-trimethylsilylcyclopropane-1-carboxylate
CID 44612781
trans-methyl (1R,2S)-2-ethenyl-1-[(2,2,2-trifluoroacetyl)amino]cyclopropane-1-carboxylate
CID 58938983
methyl 2-ethenyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]cyclopropane-1-carboxylate
CID 22091728
dimethyl (4E)-3-ethenyl-4-(trimethylsilylmethylidene)cyclopentane-1,1-dicarboxylate
CID 11120024
dimethyl 2-ethenyl-5-methyl-2,3-dihydropyrrole-4,4-dicarboxylate
CID 102364818
cis-methyl (1R,2R)-1-benzamido-2-ethenylcyclopropane-1-carboxylate
CID 102145889
dimethyl (2R,5R)-5-ethenyl-2-propan-2-yloxolane-3,3-dicarboxylate
CID 102410620
trans-methyl (1R,2S)-2-ethenyl-1-(imidazole-1-carbonylamino)cyclopropane-1-carboxylate
CID 66742386

Frequently Asked Questions

What is the IUPAC name of methyl 2-ethenyl-1-trimethylsilylcyclopropane-1-carboxylate?
The IUPAC name of methyl 2-ethenyl-1-trimethylsilylcyclopropane-1-carboxylate (CID 10856457) is methyl 2-ethenyl-1-trimethylsilylcyclopropane-1-carboxylate.
What is the SMILES notation for methyl 2-ethenyl-1-trimethylsilylcyclopropane-1-carboxylate?
The canonical SMILES for methyl 2-ethenyl-1-trimethylsilylcyclopropane-1-carboxylate is C=CC1CC1(C(=O)OC)[Si](C)(C)C.
What is the InChIKey of methyl 2-ethenyl-1-trimethylsilylcyclopropane-1-carboxylate?
The InChIKey is OMNFMTJRUWOVAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O2Si/c1-6-8-7-10(8,9(11)12-2)13(3,4)5/h6,8H,1,7H2,2-5H3.
What are the key properties of methyl 2-ethenyl-1-trimethylsilylcyclopropane-1-carboxylate?
methyl 2-ethenyl-1-trimethylsilylcyclopropane-1-carboxylate has a molecular weight of 198.34 g/mol, XLogP of 2.44, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-ethenyl-1-trimethylsilylcyclopropane-1-carboxylate is sourced from PubChem (CID 10856457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).