tributyl-[(1R)-1-(methoxymethoxy)pent-4-enyl]stannane

C19H40O2Sn — CID 11774446

IUPACtributyl-[(1R)-1-(methoxymethoxy)pent-4-enyl]stannane
SMILESC=CCC[C@H](OCOC)[Sn](CCCC)(CCCC)CCCC
InChIInChI=1S/C7H13O2.3C4H9.Sn/c1-3-4-5-6-9-7-8-2;3*1-3-4-2;/h3,6H,1,4-5,7H2,2H3;3*1,3-4H2,2H3;
InChIKeyBJSYDKOSXBGLOX-UHFFFAOYSA-N
MW419.24 g/mol
LogP6.33
Rot. Bonds16

About tributyl-[(1R)-1-(methoxymethoxy)pent-4-enyl]stannane

tributyl-[(1R)-1-(methoxymethoxy)pent-4-enyl]stannane (PubChem CID 11774446) has the molecular formula C19H40O2Sn and a molecular weight of 419.24 g/mol. Its IUPAC name is tributyl-[(1R)-1-(methoxymethoxy)pent-4-enyl]stannane.

Molecular Properties

Compound Nametributyl-[(1R)-1-(methoxymethoxy)pent-4-enyl]stannane
PubChem CID11774446
Molecular FormulaC19H40O2Sn
Molecular Weight419.24 g/mol
Exact Mass420.21
IUPAC Nametributyl-[(1R)-1-(methoxymethoxy)pent-4-enyl]stannane
SMILESC=CCC[C@H](OCOC)[Sn](CCCC)(CCCC)CCCC
InChIInChI=1S/C7H13O2.3C4H9.Sn/c1-3-4-5-6-9-7-8-2;3*1-3-4-2;/h3,6H,1,4-5,7H2,2H3;3*1,3-4H2,2H3;
InChIKeyBJSYDKOSXBGLOX-UHFFFAOYSA-N
XLogP6.33
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds16
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500419.24
LogP ≤ 56.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

tributyl(1-ethoxypentyl)stannane
CID 87709895
tributyl-[(E,1S)-1-(methoxymethoxy)but-2-enyl]stannane
CID 12839862
4-(methoxymethoxy)non-1-ene
CID 14592865
(2S)-2-(methoxymethoxy)hex-5-en-1-ol
CID 11506501
(4R)-4-(methoxymethoxy)undec-1-ene
CID 102130866
2-tributylstannyloct-7-enenitrile
CID 164521107
5,6-dipropyldec-1-ene
CID 123363407
tributyl(pent-4-enyl)stannane
CID 86003021
tributyl-[(E)-4-(methoxymethoxy)but-3-en-2-yl]stannane
CID 14902376
tributyl-[4-(methoxymethoxy)but-3-en-2-yl]stannane
CID 71341507
ethyl 4-(methoxymethoxy)oct-7-en-2-ynoate
CID 10977177
(4S,6R,8R,10R,12R,14R)-6,8,10,12,14-pentamethoxy-4-(methoxymethoxy)nonadec-1-ene
CID 46844562

Frequently Asked Questions

What is the IUPAC name of tributyl-[(1R)-1-(methoxymethoxy)pent-4-enyl]stannane?
The IUPAC name of tributyl-[(1R)-1-(methoxymethoxy)pent-4-enyl]stannane (CID 11774446) is tributyl-[(1R)-1-(methoxymethoxy)pent-4-enyl]stannane.
What is the SMILES notation for tributyl-[(1R)-1-(methoxymethoxy)pent-4-enyl]stannane?
The canonical SMILES for tributyl-[(1R)-1-(methoxymethoxy)pent-4-enyl]stannane is C=CCC[C@H](OCOC)[Sn](CCCC)(CCCC)CCCC.
What is the InChIKey of tributyl-[(1R)-1-(methoxymethoxy)pent-4-enyl]stannane?
The InChIKey is BJSYDKOSXBGLOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13O2.3C4H9.Sn/c1-3-4-5-6-9-7-8-2;3*1-3-4-2;/h3,6H,1,4-5,7H2,2H3;3*1,3-4H2,2H3;.
What are the key properties of tributyl-[(1R)-1-(methoxymethoxy)pent-4-enyl]stannane?
tributyl-[(1R)-1-(methoxymethoxy)pent-4-enyl]stannane has a molecular weight of 419.24 g/mol, XLogP of 6.33, 16 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl-[(1R)-1-(methoxymethoxy)pent-4-enyl]stannane is sourced from PubChem (CID 11774446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).