methyl (Z,2R)-2-triethylsilyloxy-5-trimethylstannylpent-4-enoate

C15H32O3SiSn — CID 44632392

IUPACmethyl (Z,2R)-2-triethylsilyloxy-5-trimethylstannylpent-4-enoate
SMILESCC[Si](CC)(CC)O[C@H](C/C=C\[Sn](C)(C)C)C(=O)OC
InChIInChI=1S/C12H23O3Si.3CH3.Sn/c1-6-10-11(12(13)14-5)15-16(7-2,8-3)9-4;;;;/h1,6,11H,7-10H2,2-5H3;3*1H3;/t11-;;;;/m1..../s1
InChIKeyLZIDGQOBVUZTCA-LOSFGHDGSA-N
MW407.22 g/mol
LogP4.37
Rot. Bonds9

About methyl (Z,2R)-2-triethylsilyloxy-5-trimethylstannylpent-4-enoate

methyl (Z,2R)-2-triethylsilyloxy-5-trimethylstannylpent-4-enoate (PubChem CID 44632392) has the molecular formula C15H32O3SiSn and a molecular weight of 407.22 g/mol. Its IUPAC name is methyl (Z,2R)-2-triethylsilyloxy-5-trimethylstannylpent-4-enoate.

Molecular Properties

Compound Namemethyl (Z,2R)-2-triethylsilyloxy-5-trimethylstannylpent-4-enoate
PubChem CID44632392
Molecular FormulaC15H32O3SiSn
Molecular Weight407.22 g/mol
Exact Mass408.11
IUPAC Namemethyl (Z,2R)-2-triethylsilyloxy-5-trimethylstannylpent-4-enoate
SMILESCC[Si](CC)(CC)O[C@H](C/C=C\[Sn](C)(C)C)C(=O)OC
InChIInChI=1S/C12H23O3Si.3CH3.Sn/c1-6-10-11(12(13)14-5)15-16(7-2,8-3)9-4;;;;/h1,6,11H,7-10H2,2-5H3;3*1H3;/t11-;;;;/m1..../s1
InChIKeyLZIDGQOBVUZTCA-LOSFGHDGSA-N
XLogP4.37
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.22
LogP ≤ 54.37
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

Ethyl 2-methyl-2-(triethylsiloxy)-4-pentenoate
CID 129741661
Ethyl 2-[tert-butyl(dimethyl)silyl]oxy-2-methylpent-4-enoate
CID 135086453
[(2R,3S)-3-[tert-butyl(dimethyl)silyl]oxypent-4-en-2-yl] butanoate
CID 154709335
Methyl 2-trimethylsilyloxybut-3-enoate
CID 156672558
Ethyl 2-[tert-butyl(dimethyl)silyl]oxypent-4-enoate
CID 171790674
Ethyl 2-trimethylsilyloxypent-4-enoate
CID 11063854
methyl (2S)-2-[tert-butyl(dimethyl)silyl]oxypent-4-enoate
CID 11806891
ethyl (2S)-2-[hexa-1,5-dien-3-yloxy-di(propan-2-yl)silyl]oxypropanoate
CID 45100851
ethyl (2R,3R)-2-[tert-butyl(dimethyl)silyl]oxy-3-methylpent-4-enoate
CID 101220207
Methyl (R)-2-[(tert-Butyldimethylsilyl)oxy]-4-pentenoate
CID 177816725

Frequently Asked Questions

What is the IUPAC name of methyl (Z,2R)-2-triethylsilyloxy-5-trimethylstannylpent-4-enoate?
The IUPAC name of methyl (Z,2R)-2-triethylsilyloxy-5-trimethylstannylpent-4-enoate (CID 44632392) is methyl (Z,2R)-2-triethylsilyloxy-5-trimethylstannylpent-4-enoate.
What is the SMILES notation for methyl (Z,2R)-2-triethylsilyloxy-5-trimethylstannylpent-4-enoate?
The canonical SMILES for methyl (Z,2R)-2-triethylsilyloxy-5-trimethylstannylpent-4-enoate is CC[Si](CC)(CC)O[C@H](C/C=C\[Sn](C)(C)C)C(=O)OC.
What is the InChIKey of methyl (Z,2R)-2-triethylsilyloxy-5-trimethylstannylpent-4-enoate?
The InChIKey is LZIDGQOBVUZTCA-LOSFGHDGSA-N. The full InChI is InChI=1S/C12H23O3Si.3CH3.Sn/c1-6-10-11(12(13)14-5)15-16(7-2,8-3)9-4;;;;/h1,6,11H,7-10H2,2-5H3;3*1H3;/t11-;;;;/m1..../s1.
What are the key properties of methyl (Z,2R)-2-triethylsilyloxy-5-trimethylstannylpent-4-enoate?
methyl (Z,2R)-2-triethylsilyloxy-5-trimethylstannylpent-4-enoate has a molecular weight of 407.22 g/mol, XLogP of 4.37, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl (Z,2R)-2-triethylsilyloxy-5-trimethylstannylpent-4-enoate is sourced from PubChem (CID 44632392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).