methyl (1R,2S,3R)-2-methyl-3-[(E)-2-trimethylsilylethenyl]cyclopropane-1-carboxylate

C11H20O2Si — CID 11009266

IUPACmethyl (1R,2S,3R)-2-methyl-3-[(E)-2-trimethylsilylethenyl]cyclopropane-1-carboxylate
SMILESCOC(=O)[C@@H]1[C@@H](C)[C@H]1/C=C/[Si](C)(C)C
InChIInChI=1S/C11H20O2Si/c1-8-9(6-7-14(3,4)5)10(8)11(12)13-2/h6-10H,1-5H3/b7-6+/t8-,9+,10+/m0/s1
InChIKeyDRHWBUVIEIMCTM-NQQXYCFQSA-N
MW212.36 g/mol
LogP2.48
Rot. Bonds3

About methyl (1R,2S,3R)-2-methyl-3-[(E)-2-trimethylsilylethenyl]cyclopropane-1-carboxylate

methyl (1R,2S,3R)-2-methyl-3-[(E)-2-trimethylsilylethenyl]cyclopropane-1-carboxylate (PubChem CID 11009266) has the molecular formula C11H20O2Si and a molecular weight of 212.36 g/mol. Its IUPAC name is methyl (1R,2S,3R)-2-methyl-3-[(E)-2-trimethylsilylethenyl]cyclopropane-1-carboxylate.

Molecular Properties

Compound Namemethyl (1R,2S,3R)-2-methyl-3-[(E)-2-trimethylsilylethenyl]cyclopropane-1-carboxylate
PubChem CID11009266
Molecular FormulaC11H20O2Si
Molecular Weight212.36 g/mol
Exact Mass212.12
IUPAC Namemethyl (1R,2S,3R)-2-methyl-3-[(E)-2-trimethylsilylethenyl]cyclopropane-1-carboxylate
SMILESCOC(=O)[C@@H]1[C@@H](C)[C@H]1/C=C/[Si](C)(C)C
InChIInChI=1S/C11H20O2Si/c1-8-9(6-7-14(3,4)5)10(8)11(12)13-2/h6-10H,1-5H3/b7-6+/t8-,9+,10+/m0/s1
InChIKeyDRHWBUVIEIMCTM-NQQXYCFQSA-N
XLogP2.48
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.36
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

methyl (1S,5R)-5-trimethylsilylcyclohex-3-ene-1-carboxylate
CID 10921824
cis-methyl (1R,2R)-2-[(E)-2-trimethylsilylethenyl]cyclopropane-1-carboxylate
CID 101400162
cis-methyl (2R,3S)-2,3-bis(ethenyl)cyclopropane-1-carboxylate
CID 102145093
methyl (1R,5R)-5-trimethylsilylcyclohex-3-ene-1-carboxylate
CID 102198541
methyl (3S)-3-[[tert-butyl(dimethyl)silyl]methyl]pent-4-enoate
CID 134893722
methyl (1S,5S)-5-trimethylsilylcyclohex-3-ene-1-carboxylate
CID 134900576
methyl (1R,5S)-5-trimethylsilylcyclohex-3-ene-1-carboxylate
CID 134944041
cis-methyl (1R,2S)-2-methyl-3-(2-trimethylsilylethenyl)cyclopropane-1-carboxylate
CID 135036885
methyl (E)-6-triethylsilylhex-5-enoate
CID 164665111
Methyl 2-allyl-3-(trimethylsilyl)-2-cyclopropene-1-carboxylate
CID 552552
4-Pentenecarboxylic acid, 2-methyl-3-methylene-4-trimethylsilyl-, methyl ester
CID 553446
Methyl 2-ethenyl-1-trimethylsilylcyclopropane-1-carboxylate
CID 10856457

Frequently Asked Questions

What is the IUPAC name of methyl (1R,2S,3R)-2-methyl-3-[(E)-2-trimethylsilylethenyl]cyclopropane-1-carboxylate?
The IUPAC name of methyl (1R,2S,3R)-2-methyl-3-[(E)-2-trimethylsilylethenyl]cyclopropane-1-carboxylate (CID 11009266) is methyl (1R,2S,3R)-2-methyl-3-[(E)-2-trimethylsilylethenyl]cyclopropane-1-carboxylate.
What is the SMILES notation for methyl (1R,2S,3R)-2-methyl-3-[(E)-2-trimethylsilylethenyl]cyclopropane-1-carboxylate?
The canonical SMILES for methyl (1R,2S,3R)-2-methyl-3-[(E)-2-trimethylsilylethenyl]cyclopropane-1-carboxylate is COC(=O)[C@@H]1[C@@H](C)[C@H]1/C=C/[Si](C)(C)C.
What is the InChIKey of methyl (1R,2S,3R)-2-methyl-3-[(E)-2-trimethylsilylethenyl]cyclopropane-1-carboxylate?
The InChIKey is DRHWBUVIEIMCTM-NQQXYCFQSA-N. The full InChI is InChI=1S/C11H20O2Si/c1-8-9(6-7-14(3,4)5)10(8)11(12)13-2/h6-10H,1-5H3/b7-6+/t8-,9+,10+/m0/s1.
What are the key properties of methyl (1R,2S,3R)-2-methyl-3-[(E)-2-trimethylsilylethenyl]cyclopropane-1-carboxylate?
methyl (1R,2S,3R)-2-methyl-3-[(E)-2-trimethylsilylethenyl]cyclopropane-1-carboxylate has a molecular weight of 212.36 g/mol, XLogP of 2.48, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methyl (1R,2S,3R)-2-methyl-3-[(E)-2-trimethylsilylethenyl]cyclopropane-1-carboxylate is sourced from PubChem (CID 11009266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).