tributyl-[(Z)-4-ethoxybut-3-en-2-yl]stannane

C18H38OSn — CID 11741033

IUPACtributyl-[(Z)-4-ethoxybut-3-en-2-yl]stannane
SMILESCCCC[Sn](CCCC)(CCCC)C(C)/C=C\OCC
InChIInChI=1S/C6H11O.3C4H9.Sn/c1-3-5-6-7-4-2;3*1-3-4-2;/h3,5-6H,4H2,1-2H3;3*1,3-4H2,2H3;/b6-5-;;;;
InChIKeyDAHLPCXLJJIGPS-YGGCHVFLSA-N
MW389.21 g/mol
LogP6.78
Rot. Bonds13

About tributyl-[(Z)-4-ethoxybut-3-en-2-yl]stannane

tributyl-[(Z)-4-ethoxybut-3-en-2-yl]stannane (PubChem CID 11741033) has the molecular formula C18H38OSn and a molecular weight of 389.21 g/mol. Its IUPAC name is tributyl-[(Z)-4-ethoxybut-3-en-2-yl]stannane.

Molecular Properties

Compound Nametributyl-[(Z)-4-ethoxybut-3-en-2-yl]stannane
PubChem CID11741033
Molecular FormulaC18H38OSn
Molecular Weight389.21 g/mol
Exact Mass390.19
IUPAC Nametributyl-[(Z)-4-ethoxybut-3-en-2-yl]stannane
SMILESCCCC[Sn](CCCC)(CCCC)C(C)/C=C\OCC
InChIInChI=1S/C6H11O.3C4H9.Sn/c1-3-5-6-7-4-2;3*1-3-4-2;/h3,5-6H,4H2,1-2H3;3*1,3-4H2,2H3;/b6-5-;;;;
InChIKeyDAHLPCXLJJIGPS-YGGCHVFLSA-N
XLogP6.78
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds13
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500389.21
LogP ≤ 56.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

Analyze tributyl-[(Z)-4-ethoxybut-3-en-2-yl]stannane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Tributyl(2,3-dihydrofuran-5-yl)stannane
CID 14323397
1-But-1-enoxybutane
CID 347145
tributyl-[(1E,3E)-4-ethoxybuta-1,3-dienyl]stannane
CID 10960038
Butenylether
CID 54078890
Dipentenyloxyd
CID 54419578
1-(Tributylstannyl)-4-ethoxybuta-diene
CID 85346461
cis-Butenyl ether
CID 129851636
cis-1-Butene,1-butoxy-
CID 5364927
1-Butene, 1-butoxy-
CID 5364928
4-Tributylstannyl-3,4-dihydropyran
CID 19600452
tributyl-[(Z)-1-ethoxy-4-methylpent-1-en-3-yl]stannane
CID 10070568
tributyl-[(Z)-1-ethoxyhept-1-en-3-yl]stannane
CID 10094254

Frequently Asked Questions

What is the IUPAC name of tributyl-[(Z)-4-ethoxybut-3-en-2-yl]stannane?
The IUPAC name of tributyl-[(Z)-4-ethoxybut-3-en-2-yl]stannane (CID 11741033) is tributyl-[(Z)-4-ethoxybut-3-en-2-yl]stannane.
What is the SMILES notation for tributyl-[(Z)-4-ethoxybut-3-en-2-yl]stannane?
The canonical SMILES for tributyl-[(Z)-4-ethoxybut-3-en-2-yl]stannane is CCCC[Sn](CCCC)(CCCC)C(C)/C=C\OCC.
What is the InChIKey of tributyl-[(Z)-4-ethoxybut-3-en-2-yl]stannane?
The InChIKey is DAHLPCXLJJIGPS-YGGCHVFLSA-N. The full InChI is InChI=1S/C6H11O.3C4H9.Sn/c1-3-5-6-7-4-2;3*1-3-4-2;/h3,5-6H,4H2,1-2H3;3*1,3-4H2,2H3;/b6-5-;;;;.
What are the key properties of tributyl-[(Z)-4-ethoxybut-3-en-2-yl]stannane?
tributyl-[(Z)-4-ethoxybut-3-en-2-yl]stannane has a molecular weight of 389.21 g/mol, XLogP of 6.78, 13 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl-[(Z)-4-ethoxybut-3-en-2-yl]stannane is sourced from PubChem (CID 11741033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).