tributyl-[(E)-1-tributylstannylbut-2-enyl]stannane

C28H60Sn2 — CID 10508278

IUPACtributyl-[(E)-1-tributylstannylbut-2-enyl]stannane
SMILESC/C=C/C([Sn](CCCC)(CCCC)CCCC)[Sn](CCCC)(CCCC)CCCC
InChIInChI=1S/6C4H9.C4H6.2Sn/c7*1-3-4-2;;/h6*1,3-4H2,2H3;1,3-4H,2H3;;/b;;;;;;4-3+;;
InChIKeyOJJFTWYQRSVRMQ-NGJXEQNTSA-N
MW634.21 g/mol
LogP11.17
Rot. Bonds21

About tributyl-[(E)-1-tributylstannylbut-2-enyl]stannane

tributyl-[(E)-1-tributylstannylbut-2-enyl]stannane (PubChem CID 10508278) has the molecular formula C28H60Sn2 and a molecular weight of 634.21 g/mol. Its IUPAC name is tributyl-[(E)-1-tributylstannylbut-2-enyl]stannane.

Molecular Properties

Compound Nametributyl-[(E)-1-tributylstannylbut-2-enyl]stannane
PubChem CID10508278
Molecular FormulaC28H60Sn2
Molecular Weight634.21 g/mol
Exact Mass636.27
IUPAC Nametributyl-[(E)-1-tributylstannylbut-2-enyl]stannane
SMILESC/C=C/C([Sn](CCCC)(CCCC)CCCC)[Sn](CCCC)(CCCC)CCCC
InChIInChI=1S/6C4H9.C4H6.2Sn/c7*1-3-4-2;;/h6*1,3-4H2,2H3;1,3-4H,2H3;;/b;;;;;;4-3+;;
InChIKeyOJJFTWYQRSVRMQ-NGJXEQNTSA-N
XLogP11.17
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds21
Heavy Atoms30
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500634.21
LogP ≤ 511.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

tributyl-[(Z,4R)-oct-2-en-4-yl]stannane
CID 177449135
tributyl-[(E,1S)-1-(methoxymethoxy)but-2-enyl]stannane
CID 12839862
[(E)-3,3-bis(tributylstannyl)prop-1-enoxy]-tert-butyl-dimethylsilane
CID 11018105
4-methyloct-2-ene
CID 528286
tributyl-[(Z)-2-tributylstannylethenyl]stannane
CID 12858946
(E)-4-methylicos-2-ene
CID 166512402
[(1R)-1-[(E)-but-2-enoxy]propyl]-tributylstannane
CID 11133191
(E)-1-tributylstannylhept-2-en-1-ol
CID 14261920
6-[(E)-prop-1-enyl]undecane
CID 134941128
tributyl(hexan-2-yl)stannane
CID 88731679
dibutyl-(2-methylbutyl)-prop-1-enylstannane
CID 173328381
octa-2,6-diene;4-prop-1-enyloct-2-ene
CID 159592466

Frequently Asked Questions

What is the IUPAC name of tributyl-[(E)-1-tributylstannylbut-2-enyl]stannane?
The IUPAC name of tributyl-[(E)-1-tributylstannylbut-2-enyl]stannane (CID 10508278) is tributyl-[(E)-1-tributylstannylbut-2-enyl]stannane.
What is the SMILES notation for tributyl-[(E)-1-tributylstannylbut-2-enyl]stannane?
The canonical SMILES for tributyl-[(E)-1-tributylstannylbut-2-enyl]stannane is C/C=C/C([Sn](CCCC)(CCCC)CCCC)[Sn](CCCC)(CCCC)CCCC.
What is the InChIKey of tributyl-[(E)-1-tributylstannylbut-2-enyl]stannane?
The InChIKey is OJJFTWYQRSVRMQ-NGJXEQNTSA-N. The full InChI is InChI=1S/6C4H9.C4H6.2Sn/c7*1-3-4-2;;/h6*1,3-4H2,2H3;1,3-4H,2H3;;/b;;;;;;4-3+;;.
What are the key properties of tributyl-[(E)-1-tributylstannylbut-2-enyl]stannane?
tributyl-[(E)-1-tributylstannylbut-2-enyl]stannane has a molecular weight of 634.21 g/mol, XLogP of 11.17, 21 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl-[(E)-1-tributylstannylbut-2-enyl]stannane is sourced from PubChem (CID 10508278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).