methyl (3R)-3-trimethylsilylcyclopentane-1-carboxylate

C10H20O2Si — CID 154716385

IUPACmethyl (3R)-3-trimethylsilylcyclopentane-1-carboxylate
SMILESCOC(=O)C1CC[C@@H]([Si](C)(C)C)C1
InChIInChI=1S/C10H20O2Si/c1-12-10(11)8-5-6-9(7-8)13(2,3)4/h8-9H,5-7H2,1-4H3/t8?,9-/m1/s1
InChIKeyITVIHLWBHFIDON-YGPZHTELSA-N
MW200.35 g/mol
LogP2.67
Rot. Bonds2

About methyl (3R)-3-trimethylsilylcyclopentane-1-carboxylate

methyl (3R)-3-trimethylsilylcyclopentane-1-carboxylate (PubChem CID 154716385) has the molecular formula C10H20O2Si and a molecular weight of 200.35 g/mol. Its IUPAC name is methyl (3R)-3-trimethylsilylcyclopentane-1-carboxylate.

Molecular Properties

Compound Namemethyl (3R)-3-trimethylsilylcyclopentane-1-carboxylate
PubChem CID154716385
Molecular FormulaC10H20O2Si
Molecular Weight200.35 g/mol
Exact Mass200.12
IUPAC Namemethyl (3R)-3-trimethylsilylcyclopentane-1-carboxylate
SMILESCOC(=O)C1CC[C@@H]([Si](C)(C)C)C1
InChIInChI=1S/C10H20O2Si/c1-12-10(11)8-5-6-9(7-8)13(2,3)4/h8-9H,5-7H2,1-4H3/t8?,9-/m1/s1
InChIKeyITVIHLWBHFIDON-YGPZHTELSA-N
XLogP2.67
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.35
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of methyl (3R)-3-trimethylsilylcyclopentane-1-carboxylate?
The IUPAC name of methyl (3R)-3-trimethylsilylcyclopentane-1-carboxylate (CID 154716385) is methyl (3R)-3-trimethylsilylcyclopentane-1-carboxylate.
What is the SMILES notation for methyl (3R)-3-trimethylsilylcyclopentane-1-carboxylate?
The canonical SMILES for methyl (3R)-3-trimethylsilylcyclopentane-1-carboxylate is COC(=O)C1CC[C@@H]([Si](C)(C)C)C1.
What is the InChIKey of methyl (3R)-3-trimethylsilylcyclopentane-1-carboxylate?
The InChIKey is ITVIHLWBHFIDON-YGPZHTELSA-N. The full InChI is InChI=1S/C10H20O2Si/c1-12-10(11)8-5-6-9(7-8)13(2,3)4/h8-9H,5-7H2,1-4H3/t8?,9-/m1/s1.
What are the key properties of methyl (3R)-3-trimethylsilylcyclopentane-1-carboxylate?
methyl (3R)-3-trimethylsilylcyclopentane-1-carboxylate has a molecular weight of 200.35 g/mol, XLogP of 2.67, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methyl (3R)-3-trimethylsilylcyclopentane-1-carboxylate is sourced from PubChem (CID 154716385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).