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

C10H18O2Si — CID 101400162

IUPACcis-methyl (1R,2R)-2-[(E)-2-trimethylsilylethenyl]cyclopropane-1-carboxylate
SMILESCOC(=O)[C@@H]1C[C@H]1/C=C/[Si](C)(C)C
InChIInChI=1S/C10H18O2Si/c1-12-10(11)9-7-8(9)5-6-13(2,3)4/h5-6,8-9H,7H2,1-4H3/b6-5+/t8-,9-/m1/s1
InChIKeyFEVRKZFOODGASL-JKKBLNIGSA-N
MW198.34 g/mol
LogP2.23
Rot. Bonds3

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

cis-methyl (1R,2R)-2-[(E)-2-trimethylsilylethenyl]cyclopropane-1-carboxylate (PubChem CID 101400162) has the molecular formula C10H18O2Si and a molecular weight of 198.34 g/mol. Its IUPAC name is cis-methyl (1R,2R)-2-[(E)-2-trimethylsilylethenyl]cyclopropane-1-carboxylate.

Molecular Properties

Compound Namecis-methyl (1R,2R)-2-[(E)-2-trimethylsilylethenyl]cyclopropane-1-carboxylate
PubChem CID101400162
Molecular FormulaC10H18O2Si
Molecular Weight198.34 g/mol
Exact Mass198.11
IUPAC Namecis-methyl (1R,2R)-2-[(E)-2-trimethylsilylethenyl]cyclopropane-1-carboxylate
SMILESCOC(=O)[C@@H]1C[C@H]1/C=C/[Si](C)(C)C
InChIInChI=1S/C10H18O2Si/c1-12-10(11)9-7-8(9)5-6-13(2,3)4/h5-6,8-9H,7H2,1-4H3/b6-5+/t8-,9-/m1/s1
InChIKeyFEVRKZFOODGASL-JKKBLNIGSA-N
XLogP2.23
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 ≤ 52.23
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 2-ethenylcyclopropane-1-carboxylate
CID 548843
Methyl (1R,2R)-2-vinylcyclopropane-1-carboxylate
CID 11018870
methyl (1R,2S,3R)-2-methyl-3-[(E)-2-trimethylsilylethenyl]cyclopropane-1-carboxylate
CID 11009266
methyl (E,2R)-5-[hydroxy(dimethyl)silyl]-2-methylpent-4-enoate
CID 44521629
cis-methyl (2R,3S)-2,3-bis(ethenyl)cyclopropane-1-carboxylate
CID 102145093
methyl (3S)-3-[[tert-butyl(dimethyl)silyl]methyl]pent-4-enoate
CID 134893722
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
Methyl 2-methyl-4-methylidene-2-trimethylsilylhex-5-enoate
CID 14569485

Frequently Asked Questions

What is the IUPAC name of cis-methyl (1R,2R)-2-[(E)-2-trimethylsilylethenyl]cyclopropane-1-carboxylate?
The IUPAC name of cis-methyl (1R,2R)-2-[(E)-2-trimethylsilylethenyl]cyclopropane-1-carboxylate (CID 101400162) is cis-methyl (1R,2R)-2-[(E)-2-trimethylsilylethenyl]cyclopropane-1-carboxylate.
What is the SMILES notation for cis-methyl (1R,2R)-2-[(E)-2-trimethylsilylethenyl]cyclopropane-1-carboxylate?
The canonical SMILES for cis-methyl (1R,2R)-2-[(E)-2-trimethylsilylethenyl]cyclopropane-1-carboxylate is COC(=O)[C@@H]1C[C@H]1/C=C/[Si](C)(C)C.
What is the InChIKey of cis-methyl (1R,2R)-2-[(E)-2-trimethylsilylethenyl]cyclopropane-1-carboxylate?
The InChIKey is FEVRKZFOODGASL-JKKBLNIGSA-N. The full InChI is InChI=1S/C10H18O2Si/c1-12-10(11)9-7-8(9)5-6-13(2,3)4/h5-6,8-9H,7H2,1-4H3/b6-5+/t8-,9-/m1/s1.
What are the key properties of cis-methyl (1R,2R)-2-[(E)-2-trimethylsilylethenyl]cyclopropane-1-carboxylate?
cis-methyl (1R,2R)-2-[(E)-2-trimethylsilylethenyl]cyclopropane-1-carboxylate has a molecular weight of 198.34 g/mol, XLogP of 2.23, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cis-methyl (1R,2R)-2-[(E)-2-trimethylsilylethenyl]cyclopropane-1-carboxylate is sourced from PubChem (CID 101400162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).