(3,4-diethyl-1,1-dimethyl-2,5-dihydrostannol-2-yl)-trimethylstannane

C13H28Sn2 — CID 15798780

IUPAC(3,4-diethyl-1,1-dimethyl-2,5-dihydrostannol-2-yl)-trimethylstannane
SMILESCCC1=C(CC)C([Sn](C)(C)C)[Sn](C)(C)C1
InChIInChI=1S/C8H13.5CH3.2Sn/c1-5-7(3)8(4)6-2;;;;;;;/h3H,4-6H2,1-2H3;5*1H3;;/b8-7-;;;;;;;
InChIKeyLHXYYLIEOPZVMB-XPSMGOJQSA-N
MW421.79 g/mol
LogP5.07
Rot. Bonds3

About (3,4-diethyl-1,1-dimethyl-2,5-dihydrostannol-2-yl)-trimethylstannane

(3,4-diethyl-1,1-dimethyl-2,5-dihydrostannol-2-yl)-trimethylstannane (PubChem CID 15798780) has the molecular formula C13H28Sn2 and a molecular weight of 421.79 g/mol. Its IUPAC name is (3,4-diethyl-1,1-dimethyl-2,5-dihydrostannol-2-yl)-trimethylstannane.

Molecular Properties

Compound Name(3,4-diethyl-1,1-dimethyl-2,5-dihydrostannol-2-yl)-trimethylstannane
PubChem CID15798780
Molecular FormulaC13H28Sn2
Molecular Weight421.79 g/mol
Exact Mass424.02
IUPAC Name(3,4-diethyl-1,1-dimethyl-2,5-dihydrostannol-2-yl)-trimethylstannane
SMILESCCC1=C(CC)C([Sn](C)(C)C)[Sn](C)(C)C1
InChIInChI=1S/C8H13.5CH3.2Sn/c1-5-7(3)8(4)6-2;;;;;;;/h3H,4-6H2,1-2H3;5*1H3;;/b8-7-;;;;;;;
InChIKeyLHXYYLIEOPZVMB-XPSMGOJQSA-N
XLogP5.07
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500421.79
LogP ≤ 55.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(E)-3,4-Dimethylhex-3-ene
CID 3034312
3,4-Diethyl-3-hexene
CID 136668
3-Ethyl-2-methyl-2-pentene
CID 140592
(Z)-3,4-dimethylhex-3-ene
CID 3034311
3-Hexene, 3-ethyl-4-methyl-
CID 142781
3,4-Dimethylhex-3-ene
CID 88151
1,1-Dibutyl-2,3,4,5-tetramethylstannole
CID 134890572
Diethyl-(4-ethyl-1,1-dimethyl-2,5-dihydrostannol-3-yl)borane
CID 135048460
1,1,2,3,4,5-Hexamethylstannole
CID 135048636
trimethyl-[(Z)-2-trimethylstannylpent-2-en-3-yl]stannane
CID 14359190
2,3,4,5-tetramethyl-2H-stibole
CID 18969852
2,3,4,5-tetramethyl-2H-bismole
CID 18970019

Frequently Asked Questions

What is the IUPAC name of (3,4-diethyl-1,1-dimethyl-2,5-dihydrostannol-2-yl)-trimethylstannane?
The IUPAC name of (3,4-diethyl-1,1-dimethyl-2,5-dihydrostannol-2-yl)-trimethylstannane (CID 15798780) is (3,4-diethyl-1,1-dimethyl-2,5-dihydrostannol-2-yl)-trimethylstannane.
What is the SMILES notation for (3,4-diethyl-1,1-dimethyl-2,5-dihydrostannol-2-yl)-trimethylstannane?
The canonical SMILES for (3,4-diethyl-1,1-dimethyl-2,5-dihydrostannol-2-yl)-trimethylstannane is CCC1=C(CC)C([Sn](C)(C)C)[Sn](C)(C)C1.
What is the InChIKey of (3,4-diethyl-1,1-dimethyl-2,5-dihydrostannol-2-yl)-trimethylstannane?
The InChIKey is LHXYYLIEOPZVMB-XPSMGOJQSA-N. The full InChI is InChI=1S/C8H13.5CH3.2Sn/c1-5-7(3)8(4)6-2;;;;;;;/h3H,4-6H2,1-2H3;5*1H3;;/b8-7-;;;;;;;.
What are the key properties of (3,4-diethyl-1,1-dimethyl-2,5-dihydrostannol-2-yl)-trimethylstannane?
(3,4-diethyl-1,1-dimethyl-2,5-dihydrostannol-2-yl)-trimethylstannane has a molecular weight of 421.79 g/mol, XLogP of 5.07, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3,4-diethyl-1,1-dimethyl-2,5-dihydrostannol-2-yl)-trimethylstannane is sourced from PubChem (CID 15798780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).