tributyl(2-tributylstannylhept-1-en-3-yl)stannane

C31H66Sn2 — CID 135007451

IUPACtributyl(2-tributylstannylhept-1-en-3-yl)stannane
SMILESC=C(C(CCCC)[Sn](CCCC)(CCCC)CCCC)[Sn](CCCC)(CCCC)CCCC
InChIInChI=1S/C7H12.6C4H9.2Sn/c1-3-5-7-6-4-2;6*1-3-4-2;;/h5H,1,4,6-7H2,2H3;6*1,3-4H2,2H3;;
InChIKeyITSKJQIZZNKHIJ-UHFFFAOYSA-N
MW676.29 g/mol
LogP12.34
Rot. Bonds24

About tributyl(2-tributylstannylhept-1-en-3-yl)stannane

tributyl(2-tributylstannylhept-1-en-3-yl)stannane (PubChem CID 135007451) has the molecular formula C31H66Sn2 and a molecular weight of 676.29 g/mol. Its IUPAC name is tributyl(2-tributylstannylhept-1-en-3-yl)stannane.

Molecular Properties

Compound Nametributyl(2-tributylstannylhept-1-en-3-yl)stannane
PubChem CID135007451
Molecular FormulaC31H66Sn2
Molecular Weight676.29 g/mol
Exact Mass678.32
IUPAC Nametributyl(2-tributylstannylhept-1-en-3-yl)stannane
SMILESC=C(C(CCCC)[Sn](CCCC)(CCCC)CCCC)[Sn](CCCC)(CCCC)CCCC
InChIInChI=1S/C7H12.6C4H9.2Sn/c1-3-5-7-6-4-2;6*1-3-4-2;;/h5H,1,4,6-7H2,2H3;6*1,3-4H2,2H3;;
InChIKeyITSKJQIZZNKHIJ-UHFFFAOYSA-N
XLogP12.34
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds24
Heavy Atoms33
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500676.29
LogP ≤ 512.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

tributyl(hexan-2-yl)stannane
CID 88731679
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CID 10527216
tributyl(dec-1-en-2-yl)stannane
CID 14784453
5-tributylstannylhex-5-enenitrile
CID 11292042
3-methyl-N-prop-1-en-2-ylheptan-2-amine
CID 174298907
tributyl(1-ethoxypentyl)stannane
CID 87709895
(1R)-2-methyl-1-tributylstannylpropan-1-ol
CID 71355540
(2R,3S)-3-tributylstannyloctan-2-ol
CID 177407142
tributyl-[(Z,4R)-oct-2-en-4-yl]stannane
CID 177449135
2-methyl-4-tributylstannylpent-4-en-2-ol
CID 15155654
5-tributylstannylhex-5-en-1-ol
CID 11773674

Frequently Asked Questions

What is the IUPAC name of tributyl(2-tributylstannylhept-1-en-3-yl)stannane?
The IUPAC name of tributyl(2-tributylstannylhept-1-en-3-yl)stannane (CID 135007451) is tributyl(2-tributylstannylhept-1-en-3-yl)stannane.
What is the SMILES notation for tributyl(2-tributylstannylhept-1-en-3-yl)stannane?
The canonical SMILES for tributyl(2-tributylstannylhept-1-en-3-yl)stannane is C=C(C(CCCC)[Sn](CCCC)(CCCC)CCCC)[Sn](CCCC)(CCCC)CCCC.
What is the InChIKey of tributyl(2-tributylstannylhept-1-en-3-yl)stannane?
The InChIKey is ITSKJQIZZNKHIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12.6C4H9.2Sn/c1-3-5-7-6-4-2;6*1-3-4-2;;/h5H,1,4,6-7H2,2H3;6*1,3-4H2,2H3;;.
What are the key properties of tributyl(2-tributylstannylhept-1-en-3-yl)stannane?
tributyl(2-tributylstannylhept-1-en-3-yl)stannane has a molecular weight of 676.29 g/mol, XLogP of 12.34, 24 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl(2-tributylstannylhept-1-en-3-yl)stannane is sourced from PubChem (CID 135007451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).