dibutyl-[dibutyl(dodecyl)stannyl]oxy-dodecylstannane

C40H86OSn2 — CID 18432072

IUPACdibutyl-[dibutyl(dodecyl)stannyl]oxy-dodecylstannane
SMILESCCCCCCCCCCCC[Sn](CCCC)(CCCC)O[Sn](CCCC)(CCCC)CCCCCCCCCCCC
InChIInChI=1S/2C12H25.4C4H9.O.2Sn/c2*1-3-5-7-9-11-12-10-8-6-4-2;4*1-3-4-2;;;/h2*1,3-12H2,2H3;4*1,3-4H2,2H3;;;
InChIKeyZFPNDVGJRZMRLW-UHFFFAOYSA-N
MW820.55 g/mol
LogP15.94
Rot. Bonds36

About dibutyl-[dibutyl(dodecyl)stannyl]oxy-dodecylstannane

dibutyl-[dibutyl(dodecyl)stannyl]oxy-dodecylstannane (PubChem CID 18432072) has the molecular formula C40H86OSn2 and a molecular weight of 820.55 g/mol. Its IUPAC name is dibutyl-[dibutyl(dodecyl)stannyl]oxy-dodecylstannane.

Molecular Properties

Compound Namedibutyl-[dibutyl(dodecyl)stannyl]oxy-dodecylstannane
PubChem CID18432072
Molecular FormulaC40H86OSn2
Molecular Weight820.55 g/mol
Exact Mass822.47
IUPAC Namedibutyl-[dibutyl(dodecyl)stannyl]oxy-dodecylstannane
SMILESCCCCCCCCCCCC[Sn](CCCC)(CCCC)O[Sn](CCCC)(CCCC)CCCCCCCCCCCC
InChIInChI=1S/2C12H25.4C4H9.O.2Sn/c2*1-3-5-7-9-11-12-10-8-6-4-2;4*1-3-4-2;;;/h2*1,3-12H2,2H3;4*1,3-4H2,2H3;;;
InChIKeyZFPNDVGJRZMRLW-UHFFFAOYSA-N
XLogP15.94
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds36
Heavy Atoms43
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500820.55
LogP ≤ 515.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze dibutyl-[dibutyl(dodecyl)stannyl]oxy-dodecylstannane 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

tri(nonyl)-tri(nonyl)stannyloxystannane
CID 23295113
trioctyl(pentoxy)stannane
CID 87643879
tributyl(hexadecyl)stannane
CID 174658060
tributyl-[butyl(dipentoxy)stannyl]oxystannane
CID 87861161
methoxymethane;undecane
CID 174775722
butyl(trioctyl)stannane;hydrochloride
CID 175572560
decane;ruthenium
CID 160818595
dibutyl-ethyl-nonoxystannane
CID 87372414
dibutyl-ethyl-heptoxystannane
CID 87371470
diethyl-hexoxy-octylstannane
CID 149251797
diheptyl(dioctyl)stannane
CID 152736724
2-ethylbutoxy(trioctyl)stannane
CID 87372569

Frequently Asked Questions

What is the IUPAC name of dibutyl-[dibutyl(dodecyl)stannyl]oxy-dodecylstannane?
The IUPAC name of dibutyl-[dibutyl(dodecyl)stannyl]oxy-dodecylstannane (CID 18432072) is dibutyl-[dibutyl(dodecyl)stannyl]oxy-dodecylstannane.
What is the SMILES notation for dibutyl-[dibutyl(dodecyl)stannyl]oxy-dodecylstannane?
The canonical SMILES for dibutyl-[dibutyl(dodecyl)stannyl]oxy-dodecylstannane is CCCCCCCCCCCC[Sn](CCCC)(CCCC)O[Sn](CCCC)(CCCC)CCCCCCCCCCCC.
What is the InChIKey of dibutyl-[dibutyl(dodecyl)stannyl]oxy-dodecylstannane?
The InChIKey is ZFPNDVGJRZMRLW-UHFFFAOYSA-N. The full InChI is InChI=1S/2C12H25.4C4H9.O.2Sn/c2*1-3-5-7-9-11-12-10-8-6-4-2;4*1-3-4-2;;;/h2*1,3-12H2,2H3;4*1,3-4H2,2H3;;;.
What are the key properties of dibutyl-[dibutyl(dodecyl)stannyl]oxy-dodecylstannane?
dibutyl-[dibutyl(dodecyl)stannyl]oxy-dodecylstannane has a molecular weight of 820.55 g/mol, XLogP of 15.94, 36 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dibutyl-[dibutyl(dodecyl)stannyl]oxy-dodecylstannane is sourced from PubChem (CID 18432072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).