3-ethenyl-1,1-dimethyl-2,5-dihydrostannole

C8H14Sn — CID 177389165

IUPAC3-ethenyl-1,1-dimethyl-2,5-dihydrostannole
SMILESC=CC1=CC[Sn](C)(C)C1
InChIInChI=1S/C6H8.2CH3.Sn/c1-4-6(3)5-2;;;/h4-5H,1-3H2;2*1H3;/b6-4+;;;
InChIKeyNZEOWJRJBGYEFI-VFKQLSEOSA-N
MW228.91 g/mol
LogP2.82
Rot. Bonds1

About 3-ethenyl-1,1-dimethyl-2,5-dihydrostannole

3-ethenyl-1,1-dimethyl-2,5-dihydrostannole (PubChem CID 177389165) has the molecular formula C8H14Sn and a molecular weight of 228.91 g/mol. Its IUPAC name is 3-ethenyl-1,1-dimethyl-2,5-dihydrostannole.

Molecular Properties

Compound Name3-ethenyl-1,1-dimethyl-2,5-dihydrostannole
PubChem CID177389165
Molecular FormulaC8H14Sn
Molecular Weight228.91 g/mol
Exact Mass230.01
IUPAC Name3-ethenyl-1,1-dimethyl-2,5-dihydrostannole
SMILESC=CC1=CC[Sn](C)(C)C1
InChIInChI=1S/C6H8.2CH3.Sn/c1-4-6(3)5-2;;;/h4-5H,1-3H2;2*1H3;/b6-4+;;;
InChIKeyNZEOWJRJBGYEFI-VFKQLSEOSA-N
XLogP2.82
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.91
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 3-ethenyl-1,1-dimethyl-2,5-dihydrostannole?
The IUPAC name of 3-ethenyl-1,1-dimethyl-2,5-dihydrostannole (CID 177389165) is 3-ethenyl-1,1-dimethyl-2,5-dihydrostannole.
What is the SMILES notation for 3-ethenyl-1,1-dimethyl-2,5-dihydrostannole?
The canonical SMILES for 3-ethenyl-1,1-dimethyl-2,5-dihydrostannole is C=CC1=CC[Sn](C)(C)C1.
What is the InChIKey of 3-ethenyl-1,1-dimethyl-2,5-dihydrostannole?
The InChIKey is NZEOWJRJBGYEFI-VFKQLSEOSA-N. The full InChI is InChI=1S/C6H8.2CH3.Sn/c1-4-6(3)5-2;;;/h4-5H,1-3H2;2*1H3;/b6-4+;;;.
What are the key properties of 3-ethenyl-1,1-dimethyl-2,5-dihydrostannole?
3-ethenyl-1,1-dimethyl-2,5-dihydrostannole has a molecular weight of 228.91 g/mol, XLogP of 2.82, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethenyl-1,1-dimethyl-2,5-dihydrostannole is sourced from PubChem (CID 177389165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).