tert-butyl-dimethyl-[(3R)-1-tributylstannyloct-1-en-3-yl]oxysilane

C26H56OSiSn — CID 173153144

IUPACtert-butyl-dimethyl-[(3R)-1-tributylstannyloct-1-en-3-yl]oxysilane
SMILESCCCCC[C@H](C=C[Sn](CCCC)(CCCC)CCCC)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C14H29OSi.3C4H9.Sn/c1-8-10-11-12-13(9-2)15-16(6,7)14(3,4)5;3*1-3-4-2;/h2,9,13H,8,10-12H2,1,3-7H3;3*1,3-4H2,2H3;/t13-;;;;/m0..../s1
InChIKeyFUTUSXSQAOMLCH-AHJYMZSGSA-N
MW531.53 g/mol
LogP9.90
Rot. Bonds17

About tert-butyl-dimethyl-[(3R)-1-tributylstannyloct-1-en-3-yl]oxysilane

tert-butyl-dimethyl-[(3R)-1-tributylstannyloct-1-en-3-yl]oxysilane (PubChem CID 173153144) has the molecular formula C26H56OSiSn and a molecular weight of 531.53 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(3R)-1-tributylstannyloct-1-en-3-yl]oxysilane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(3R)-1-tributylstannyloct-1-en-3-yl]oxysilane
PubChem CID173153144
Molecular FormulaC26H56OSiSn
Molecular Weight531.53 g/mol
Exact Mass532.31
IUPAC Nametert-butyl-dimethyl-[(3R)-1-tributylstannyloct-1-en-3-yl]oxysilane
SMILESCCCCC[C@H](C=C[Sn](CCCC)(CCCC)CCCC)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C14H29OSi.3C4H9.Sn/c1-8-10-11-12-13(9-2)15-16(6,7)14(3,4)5;3*1-3-4-2;/h2,9,13H,8,10-12H2,1,3-7H3;3*1,3-4H2,2H3;/t13-;;;;/m0..../s1
InChIKeyFUTUSXSQAOMLCH-AHJYMZSGSA-N
XLogP9.90
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds17
Heavy Atoms29
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500531.53
LogP ≤ 59.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

trimethyl-[(E)-1-tributylstannyloct-1-en-3-yl]oxysilane
CID 19846630
methyl (E,5S)-5-[tert-butyl(dimethyl)silyl]oxy-7-tributylstannylhept-6-enoate
CID 57407910
tert-butyl-(1-iodooct-1-en-3-yloxy)-dimethylsilane
CID 53400857
(1E,3S,4R,5E)-4-[tert-butyl(dimethyl)silyl]oxy-1,6-bis(tributylstannyl)hexa-1,5-dien-3-ol
CID 177475405
(E,3S,5S)-3-[tert-butyl(dimethyl)silyl]oxy-7-tributylstannyl-5-tri(propan-2-yl)silyloxyhept-6-en-1-ol
CID 11468178
(2S)-2-[tert-butyl(dimethyl)silyl]oxyheptanal
CID 10490533
[(1R,2S)-2,5-bis[[tert-butyl(dimethyl)silyl]oxy]-1-[(E)-2-tributylstannylethenyl]pentoxy]-tert-butyl-dimethylsilane
CID 10700411
2-[tert-butyl(dimethyl)silyl]oxytridecanal
CID 170917454
tert-butyl-[(E,3S)-4,4-difluoro-1-tributylstannyloct-1-en-3-yl]oxy-dimethylsilane
CID 87758729
4-[tert-butyl(dimethyl)silyl]oxyoct-2-enal
CID 71343055
tert-butyl-dimethyl-[(7E,9Z)-12-trimethylsilyldodeca-7,9-dien-11-yn-6-yl]oxysilane
CID 11024906
(E,2S,3R,6R)-1,3,6-tris[[tert-butyl(dimethyl)silyl]oxy]octadec-4-en-2-amine
CID 11365820

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[(3R)-1-tributylstannyloct-1-en-3-yl]oxysilane?
The IUPAC name of tert-butyl-dimethyl-[(3R)-1-tributylstannyloct-1-en-3-yl]oxysilane (CID 173153144) is tert-butyl-dimethyl-[(3R)-1-tributylstannyloct-1-en-3-yl]oxysilane.
What is the SMILES notation for tert-butyl-dimethyl-[(3R)-1-tributylstannyloct-1-en-3-yl]oxysilane?
The canonical SMILES for tert-butyl-dimethyl-[(3R)-1-tributylstannyloct-1-en-3-yl]oxysilane is CCCCC[C@H](C=C[Sn](CCCC)(CCCC)CCCC)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-[(3R)-1-tributylstannyloct-1-en-3-yl]oxysilane?
The InChIKey is FUTUSXSQAOMLCH-AHJYMZSGSA-N. The full InChI is InChI=1S/C14H29OSi.3C4H9.Sn/c1-8-10-11-12-13(9-2)15-16(6,7)14(3,4)5;3*1-3-4-2;/h2,9,13H,8,10-12H2,1,3-7H3;3*1,3-4H2,2H3;/t13-;;;;/m0..../s1.
What are the key properties of tert-butyl-dimethyl-[(3R)-1-tributylstannyloct-1-en-3-yl]oxysilane?
tert-butyl-dimethyl-[(3R)-1-tributylstannyloct-1-en-3-yl]oxysilane has a molecular weight of 531.53 g/mol, XLogP of 9.90, 17 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(3R)-1-tributylstannyloct-1-en-3-yl]oxysilane is sourced from PubChem (CID 173153144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).