dibutyl-ethyl-heptoxystannane

C17H38OSn — CID 87371470

IUPACdibutyl-ethyl-heptoxystannane
SMILESCCCCCCCO[Sn](CC)(CCCC)CCCC
InChIInChI=1S/C7H15O.2C4H9.C2H5.Sn/c1-2-3-4-5-6-7-8;2*1-3-4-2;1-2;/h2-7H2,1H3;2*1,3-4H2,2H3;1H2,2H3;/q-1;;;;+1
InChIKeyVFSFUPAKOGOGKT-UHFFFAOYSA-N
MW377.20 g/mol
LogP6.54
Rot. Bonds14

About dibutyl-ethyl-heptoxystannane

dibutyl-ethyl-heptoxystannane (PubChem CID 87371470) has the molecular formula C17H38OSn and a molecular weight of 377.20 g/mol. Its IUPAC name is dibutyl-ethyl-heptoxystannane.

Molecular Properties

Compound Namedibutyl-ethyl-heptoxystannane
PubChem CID87371470
Molecular FormulaC17H38OSn
Molecular Weight377.20 g/mol
Exact Mass378.19
IUPAC Namedibutyl-ethyl-heptoxystannane
SMILESCCCCCCCO[Sn](CC)(CCCC)CCCC
InChIInChI=1S/C7H15O.2C4H9.C2H5.Sn/c1-2-3-4-5-6-7-8;2*1-3-4-2;1-2;/h2-7H2,1H3;2*1,3-4H2,2H3;1H2,2H3;/q-1;;;;+1
InChIKeyVFSFUPAKOGOGKT-UHFFFAOYSA-N
XLogP6.54
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds14
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500377.20
LogP ≤ 56.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

dibutyl-ethyl-nonoxystannane
CID 87372414
diethyl-hexoxy-octylstannane
CID 149251797
trioctyl(pentoxy)stannane
CID 87643879
dibutyl-di(nonoxy)stannane
CID 87642820
tributyl-[butyl(dipentoxy)stannyl]oxystannane
CID 87861161
decoxy-[decoxy(dimethyl)stannyl]oxy-dimethylstannane
CID 23073861
butyl-(butyl-methyl-nonoxystannyl)oxy-methyl-nonoxystannane
CID 23115062
dibutyl-[dibutyl(dodecyl)stannyl]oxy-dodecylstannane
CID 18432072
2-tributylstannyloxy-N,N-bis(2-tributylstannyloxyethyl)ethanamine
CID 16689184
butyl-(butyl-methyl-pentoxystannyl)oxy-methyl-pentoxystannane
CID 23115045
tri(nonyl)-tri(nonyl)stannyloxystannane
CID 23295113
methoxymethane;undecane
CID 174775722

Frequently Asked Questions

What is the IUPAC name of dibutyl-ethyl-heptoxystannane?
The IUPAC name of dibutyl-ethyl-heptoxystannane (CID 87371470) is dibutyl-ethyl-heptoxystannane.
What is the SMILES notation for dibutyl-ethyl-heptoxystannane?
The canonical SMILES for dibutyl-ethyl-heptoxystannane is CCCCCCCO[Sn](CC)(CCCC)CCCC.
What is the InChIKey of dibutyl-ethyl-heptoxystannane?
The InChIKey is VFSFUPAKOGOGKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15O.2C4H9.C2H5.Sn/c1-2-3-4-5-6-7-8;2*1-3-4-2;1-2;/h2-7H2,1H3;2*1,3-4H2,2H3;1H2,2H3;/q-1;;;;+1.
What are the key properties of dibutyl-ethyl-heptoxystannane?
dibutyl-ethyl-heptoxystannane has a molecular weight of 377.20 g/mol, XLogP of 6.54, 14 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dibutyl-ethyl-heptoxystannane is sourced from PubChem (CID 87371470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).