dioctyl(dipropoxy)stannane

C22H48O2Sn — CID 87371484

IUPACdioctyl(dipropoxy)stannane
SMILESCCCCCCCC[Sn](CCCCCCCC)(OCCC)OCCC
InChIInChI=1S/2C8H17.2C3H7O.Sn/c2*1-3-5-7-8-6-4-2;2*1-2-3-4;/h2*1,3-8H2,2H3;2*2-3H2,1H3;/q;;2*-1;+2
InChIKeyHFVQXGCTVXINBY-UHFFFAOYSA-N
MW463.34 g/mol
LogP8.00
Rot. Bonds20

About dioctyl(dipropoxy)stannane

dioctyl(dipropoxy)stannane (PubChem CID 87371484) has the molecular formula C22H48O2Sn and a molecular weight of 463.34 g/mol. Its IUPAC name is dioctyl(dipropoxy)stannane.

Molecular Properties

Compound Namedioctyl(dipropoxy)stannane
PubChem CID87371484
Molecular FormulaC22H48O2Sn
Molecular Weight463.34 g/mol
Exact Mass464.27
IUPAC Namedioctyl(dipropoxy)stannane
SMILESCCCCCCCC[Sn](CCCCCCCC)(OCCC)OCCC
InChIInChI=1S/2C8H17.2C3H7O.Sn/c2*1-3-5-7-8-6-4-2;2*1-2-3-4;/h2*1,3-8H2,2H3;2*2-3H2,1H3;/q;;2*-1;+2
InChIKeyHFVQXGCTVXINBY-UHFFFAOYSA-N
XLogP8.00
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds20
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500463.34
LogP ≤ 58.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

dibutyl-di(nonoxy)stannane
CID 87642820
di(nonoxy)-bis(4,4,4-trifluorobutyl)stannane
CID 87372284
dipropoxy-bis(4,4,4-trifluorobutyl)stannane
CID 87371066
dibutyl(diethoxy)stannane
CID 16693734
trioctyl(pentoxy)stannane
CID 87643879
[dioctyl(triethoxysilyloxy)stannyl] triethyl silicate
CID 154204012
butylperoxy-[butylperoxy(dioctyl)stannyl]oxy-dioctylstannane
CID 150262584
decane;ruthenium
CID 160818595
diethyl-hexoxy-octylstannane
CID 149251797
[[butoxy(dioctyl)stannyl]oxy-dioctylstannyl] butyl carbonate
CID 141184710
diheptyl(dioctyl)stannane
CID 152736724
tri(nonyl)-tri(nonyl)stannyloxystannane
CID 23295113

Frequently Asked Questions

What is the IUPAC name of dioctyl(dipropoxy)stannane?
The IUPAC name of dioctyl(dipropoxy)stannane (CID 87371484) is dioctyl(dipropoxy)stannane.
What is the SMILES notation for dioctyl(dipropoxy)stannane?
The canonical SMILES for dioctyl(dipropoxy)stannane is CCCCCCCC[Sn](CCCCCCCC)(OCCC)OCCC.
What is the InChIKey of dioctyl(dipropoxy)stannane?
The InChIKey is HFVQXGCTVXINBY-UHFFFAOYSA-N. The full InChI is InChI=1S/2C8H17.2C3H7O.Sn/c2*1-3-5-7-8-6-4-2;2*1-2-3-4;/h2*1,3-8H2,2H3;2*2-3H2,1H3;/q;;2*-1;+2.
What are the key properties of dioctyl(dipropoxy)stannane?
dioctyl(dipropoxy)stannane has a molecular weight of 463.34 g/mol, XLogP of 8.00, 20 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dioctyl(dipropoxy)stannane is sourced from PubChem (CID 87371484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).