tributyl(4-tributylstannylbut-3-enoxy)stannane

C28H60OSn2 — CID 141193186

IUPACtributyl(4-tributylstannylbut-3-enoxy)stannane
SMILESCCCC[Sn](C=CCCO[Sn](CCCC)(CCCC)CCCC)(CCCC)CCCC
InChIInChI=1S/C4H6O.6C4H9.2Sn/c1-2-3-4-5;6*1-3-4-2;;/h1-2H,3-4H2;6*1,3-4H2,2H3;;/q-1;;;;;;;;+1
InChIKeyHCIQEXNYDNJMPT-UHFFFAOYSA-N
MW650.21 g/mol
LogP10.68
Rot. Bonds23

About tributyl(4-tributylstannylbut-3-enoxy)stannane

tributyl(4-tributylstannylbut-3-enoxy)stannane (PubChem CID 141193186) has the molecular formula C28H60OSn2 and a molecular weight of 650.21 g/mol. Its IUPAC name is tributyl(4-tributylstannylbut-3-enoxy)stannane.

Molecular Properties

Compound Nametributyl(4-tributylstannylbut-3-enoxy)stannane
PubChem CID141193186
Molecular FormulaC28H60OSn2
Molecular Weight650.21 g/mol
Exact Mass652.27
IUPAC Nametributyl(4-tributylstannylbut-3-enoxy)stannane
SMILESCCCC[Sn](C=CCCO[Sn](CCCC)(CCCC)CCCC)(CCCC)CCCC
InChIInChI=1S/C4H6O.6C4H9.2Sn/c1-2-3-4-5;6*1-3-4-2;;/h1-2H,3-4H2;6*1,3-4H2,2H3;;/q-1;;;;;;;;+1
InChIKeyHCIQEXNYDNJMPT-UHFFFAOYSA-N
XLogP10.68
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds23
Heavy Atoms31
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500650.21
LogP ≤ 510.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-tributylstannyloxy-N,N-bis(2-tributylstannyloxyethyl)ethanamine
CID 16689184
tributyl-[(Z)-2-tributylstannylethenyl]stannane
CID 12858946
(E)-7-tributylstannylhept-6-enenitrile
CID 19007719
(E)-3-tributylstannylprop-2-en-1-amine
CID 45040600
trioctyl(pentoxy)stannane
CID 87643879
tributyl-[(Z)-4-phenylsulfanylbut-1-enyl]stannane
CID 15640193
tributyl-[(E)-4,4-diethoxybut-1-enyl]stannane
CID 10574786
tributyl-[(E)-5-phenylpent-1-enyl]stannane
CID 12793749
tributyl-[(1E)-4-methylpenta-1,4-dienyl]stannane
CID 11257245
(E)-4-tributylstannylbut-3-enoic acid
CID 11767530
dibutyl-ethyl-heptoxystannane
CID 87371470
dibutyl-ethyl-nonoxystannane
CID 87372414

Frequently Asked Questions

What is the IUPAC name of tributyl(4-tributylstannylbut-3-enoxy)stannane?
The IUPAC name of tributyl(4-tributylstannylbut-3-enoxy)stannane (CID 141193186) is tributyl(4-tributylstannylbut-3-enoxy)stannane.
What is the SMILES notation for tributyl(4-tributylstannylbut-3-enoxy)stannane?
The canonical SMILES for tributyl(4-tributylstannylbut-3-enoxy)stannane is CCCC[Sn](C=CCCO[Sn](CCCC)(CCCC)CCCC)(CCCC)CCCC.
What is the InChIKey of tributyl(4-tributylstannylbut-3-enoxy)stannane?
The InChIKey is HCIQEXNYDNJMPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6O.6C4H9.2Sn/c1-2-3-4-5;6*1-3-4-2;;/h1-2H,3-4H2;6*1,3-4H2,2H3;;/q-1;;;;;;;;+1.
What are the key properties of tributyl(4-tributylstannylbut-3-enoxy)stannane?
tributyl(4-tributylstannylbut-3-enoxy)stannane has a molecular weight of 650.21 g/mol, XLogP of 10.68, 23 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl(4-tributylstannylbut-3-enoxy)stannane is sourced from PubChem (CID 141193186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).