trimethyl-[2-[[(E,2S)-5-tributylstannylpent-3-en-2-yl]oxymethoxy]ethyl]silane

C23H50O2SiSn — CID 10720321

IUPACtrimethyl-[2-[[(E,2S)-5-tributylstannylpent-3-en-2-yl]oxymethoxy]ethyl]silane
SMILESCCCC[Sn](C/C=C/[C@H](C)OCOCC[Si](C)(C)C)(CCCC)CCCC
InChIInChI=1S/C11H23O2Si.3C4H9.Sn/c1-6-7-11(2)13-10-12-8-9-14(3,4)5;3*1-3-4-2;/h6-7,11H,1,8-10H2,2-5H3;3*1,3-4H2,2H3;/b7-6+;;;;/t11-;;;;/m0..../s1
InChIKeyPTLAYJMZLWUULN-PSOIKBBJSA-N
MW505.45 g/mol
LogP8.11
Rot. Bonds18

About trimethyl-[2-[[(E,2S)-5-tributylstannylpent-3-en-2-yl]oxymethoxy]ethyl]silane

trimethyl-[2-[[(E,2S)-5-tributylstannylpent-3-en-2-yl]oxymethoxy]ethyl]silane (PubChem CID 10720321) has the molecular formula C23H50O2SiSn and a molecular weight of 505.45 g/mol. Its IUPAC name is trimethyl-[2-[[(E,2S)-5-tributylstannylpent-3-en-2-yl]oxymethoxy]ethyl]silane.

Molecular Properties

Compound Nametrimethyl-[2-[[(E,2S)-5-tributylstannylpent-3-en-2-yl]oxymethoxy]ethyl]silane
PubChem CID10720321
Molecular FormulaC23H50O2SiSn
Molecular Weight505.45 g/mol
Exact Mass506.26
IUPAC Nametrimethyl-[2-[[(E,2S)-5-tributylstannylpent-3-en-2-yl]oxymethoxy]ethyl]silane
SMILESCCCC[Sn](C/C=C/[C@H](C)OCOCC[Si](C)(C)C)(CCCC)CCCC
InChIInChI=1S/C11H23O2Si.3C4H9.Sn/c1-6-7-11(2)13-10-12-8-9-14(3,4)5;3*1-3-4-2;/h6-7,11H,1,8-10H2,2-5H3;3*1,3-4H2,2H3;/b7-6+;;;;/t11-;;;;/m0..../s1
InChIKeyPTLAYJMZLWUULN-PSOIKBBJSA-N
XLogP8.11
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds18
Heavy Atoms27
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500505.45
LogP ≤ 58.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(2r,5s)-(z)-2-Methoxy-5-(triisopropylsilyloxy)hex-3-ene
CID 129826301
(2s,5s)-(z)-2-Methoxy-5-(triisopropylsilyloxy)hex-3-ene
CID 129826316
tert-butyl-[(E,2S)-4-(methoxymethoxymethyl)hex-3-en-2-yl]oxy-dimethylsilane
CID 135019503
tert-butyl-dimethyl-[(E,2S)-5-tributylstannyl-2-(2-trimethylsilylethoxymethoxy)pent-3-enoxy]silane
CID 10508301
CID 170724386
CID 170724386
trimethyl-[2-[[(E,2S)-5-trichlorostannylpent-3-en-2-yl]oxymethoxy]ethyl]silane
CID 10527061
tert-butyl-dimethyl-[(E,6R)-6-tributylstannyl-6-(2-trimethylsilylethoxymethoxy)hex-4-enoxy]silane
CID 10532271
trimethyl-[2-[[(E,1S)-1-tributylstannylpent-2-enoxy]methoxy]ethyl]silane
CID 10577478
tert-butyl-dimethyl-[(E,2S)-5-trichlorostannyl-2-(2-trimethylsilylethoxymethoxy)pent-3-enoxy]silane
CID 10578966
trimethyl-[2-[[(E)-5-tributylstannylpent-3-en-2-yl]oxymethoxy]ethyl]silane
CID 11016623
tributyl-[(E,1R)-1-(methoxymethoxy)pent-2-enyl]stannane
CID 15694475
tributyl-[(E,1S)-1-(methoxymethoxy)pent-2-enyl]stannane
CID 15694476

Frequently Asked Questions

What is the IUPAC name of trimethyl-[2-[[(E,2S)-5-tributylstannylpent-3-en-2-yl]oxymethoxy]ethyl]silane?
The IUPAC name of trimethyl-[2-[[(E,2S)-5-tributylstannylpent-3-en-2-yl]oxymethoxy]ethyl]silane (CID 10720321) is trimethyl-[2-[[(E,2S)-5-tributylstannylpent-3-en-2-yl]oxymethoxy]ethyl]silane.
What is the SMILES notation for trimethyl-[2-[[(E,2S)-5-tributylstannylpent-3-en-2-yl]oxymethoxy]ethyl]silane?
The canonical SMILES for trimethyl-[2-[[(E,2S)-5-tributylstannylpent-3-en-2-yl]oxymethoxy]ethyl]silane is CCCC[Sn](C/C=C/[C@H](C)OCOCC[Si](C)(C)C)(CCCC)CCCC.
What is the InChIKey of trimethyl-[2-[[(E,2S)-5-tributylstannylpent-3-en-2-yl]oxymethoxy]ethyl]silane?
The InChIKey is PTLAYJMZLWUULN-PSOIKBBJSA-N. The full InChI is InChI=1S/C11H23O2Si.3C4H9.Sn/c1-6-7-11(2)13-10-12-8-9-14(3,4)5;3*1-3-4-2;/h6-7,11H,1,8-10H2,2-5H3;3*1,3-4H2,2H3;/b7-6+;;;;/t11-;;;;/m0..../s1.
What are the key properties of trimethyl-[2-[[(E,2S)-5-tributylstannylpent-3-en-2-yl]oxymethoxy]ethyl]silane?
trimethyl-[2-[[(E,2S)-5-tributylstannylpent-3-en-2-yl]oxymethoxy]ethyl]silane has a molecular weight of 505.45 g/mol, XLogP of 8.11, 18 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[2-[[(E,2S)-5-tributylstannylpent-3-en-2-yl]oxymethoxy]ethyl]silane is sourced from PubChem (CID 10720321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).