trimethyl-[(E)-1-(2-methylprop-2-enoxy)-3-trimethylstannylprop-1-en-2-yl]stannane

C13H28OSn2 — CID 134889684

IUPACtrimethyl-[(E)-1-(2-methylprop-2-enoxy)-3-trimethylstannylprop-1-en-2-yl]stannane
SMILESC=C(C)CO/C=C(\C[Sn](C)(C)C)[Sn](C)(C)C
InChIInChI=1S/C7H10O.6CH3.2Sn/c1-4-5-8-6-7(2)3;;;;;;;;/h5H,1-2,6H2,3H3;6*1H3;;
InChIKeyKSDIOLAMJKBLTQ-UHFFFAOYSA-N
MW437.79 g/mol
LogP4.68
Rot. Bonds6

About trimethyl-[(E)-1-(2-methylprop-2-enoxy)-3-trimethylstannylprop-1-en-2-yl]stannane

trimethyl-[(E)-1-(2-methylprop-2-enoxy)-3-trimethylstannylprop-1-en-2-yl]stannane (PubChem CID 134889684) has the molecular formula C13H28OSn2 and a molecular weight of 437.79 g/mol. Its IUPAC name is trimethyl-[(E)-1-(2-methylprop-2-enoxy)-3-trimethylstannylprop-1-en-2-yl]stannane.

Molecular Properties

Compound Nametrimethyl-[(E)-1-(2-methylprop-2-enoxy)-3-trimethylstannylprop-1-en-2-yl]stannane
PubChem CID134889684
Molecular FormulaC13H28OSn2
Molecular Weight437.79 g/mol
Exact Mass440.02
IUPAC Nametrimethyl-[(E)-1-(2-methylprop-2-enoxy)-3-trimethylstannylprop-1-en-2-yl]stannane
SMILESC=C(C)CO/C=C(\C[Sn](C)(C)C)[Sn](C)(C)C
InChIInChI=1S/C7H10O.6CH3.2Sn/c1-4-5-8-6-7(2)3;;;;;;;;/h5H,1-2,6H2,3H3;6*1H3;;
InChIKeyKSDIOLAMJKBLTQ-UHFFFAOYSA-N
XLogP4.68
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.79
LogP ≤ 54.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

[(Z)-3-methoxy-1-trimethylstannylprop-1-en-2-yl]-trimethylstannane
CID 12663695
3-Methyl-1-(2-methylprop-1-enoxy)but-2-ene
CID 10534752
(E)-1,3-dimethoxy-2-methylprop-1-ene
CID 54503741
(E)-3-ethenoxy-2-methyl-1-(2-methylprop-2-enoxy)prop-1-ene
CID 58101234
(Z)-1-ethoxy-3-methoxy-2-methylprop-1-ene
CID 59592534
Trimethyl(2-methylprop-2-enoxymethyl)germane
CID 87326073
2-Methyl-3-propa-1,2-dienoxyprop-1-ene
CID 88438924
Ethane;3-ethenoxy-2-methylprop-1-ene
CID 144862314
Methane;3-methoxy-2-methylprop-1-ene
CID 157141754
Methane;3-methoxy-2-methylprop-1-ene
CID 158796314
(Z)-1-ethoxy-3-methoxy-2-methylprop-1-ene;methane
CID 159559152
methane;(Z)-3-methoxy-2-methyl-1-prop-1-enoxyprop-1-ene
CID 160142072

Frequently Asked Questions

What is the IUPAC name of trimethyl-[(E)-1-(2-methylprop-2-enoxy)-3-trimethylstannylprop-1-en-2-yl]stannane?
The IUPAC name of trimethyl-[(E)-1-(2-methylprop-2-enoxy)-3-trimethylstannylprop-1-en-2-yl]stannane (CID 134889684) is trimethyl-[(E)-1-(2-methylprop-2-enoxy)-3-trimethylstannylprop-1-en-2-yl]stannane.
What is the SMILES notation for trimethyl-[(E)-1-(2-methylprop-2-enoxy)-3-trimethylstannylprop-1-en-2-yl]stannane?
The canonical SMILES for trimethyl-[(E)-1-(2-methylprop-2-enoxy)-3-trimethylstannylprop-1-en-2-yl]stannane is C=C(C)CO/C=C(\C[Sn](C)(C)C)[Sn](C)(C)C.
What is the InChIKey of trimethyl-[(E)-1-(2-methylprop-2-enoxy)-3-trimethylstannylprop-1-en-2-yl]stannane?
The InChIKey is KSDIOLAMJKBLTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10O.6CH3.2Sn/c1-4-5-8-6-7(2)3;;;;;;;;/h5H,1-2,6H2,3H3;6*1H3;;.
What are the key properties of trimethyl-[(E)-1-(2-methylprop-2-enoxy)-3-trimethylstannylprop-1-en-2-yl]stannane?
trimethyl-[(E)-1-(2-methylprop-2-enoxy)-3-trimethylstannylprop-1-en-2-yl]stannane has a molecular weight of 437.79 g/mol, XLogP of 4.68, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(E)-1-(2-methylprop-2-enoxy)-3-trimethylstannylprop-1-en-2-yl]stannane is sourced from PubChem (CID 134889684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).