(4E)-4-(2,2-dimethylpropylidene)-2,2,6-trimethyl-3-methylideneoxasilinane

C13H24OSi — CID 134966621

IUPAC(4E)-4-(2,2-dimethylpropylidene)-2,2,6-trimethyl-3-methylideneoxasilinane
SMILESC=C1/C(=C/C(C)(C)C)CC(C)O[Si]1(C)C
InChIInChI=1S/C13H24OSi/c1-10-8-12(9-13(3,4)5)11(2)15(6,7)14-10/h9-10H,2,8H2,1,3-7H3/b12-9+
InChIKeyBDQALQOLLIWHTN-FMIVXFBMSA-N
MW224.42 g/mol
LogP4.07
Rot. Bonds

About (4E)-4-(2,2-dimethylpropylidene)-2,2,6-trimethyl-3-methylideneoxasilinane

(4E)-4-(2,2-dimethylpropylidene)-2,2,6-trimethyl-3-methylideneoxasilinane (PubChem CID 134966621) has the molecular formula C13H24OSi and a molecular weight of 224.42 g/mol. Its IUPAC name is (4E)-4-(2,2-dimethylpropylidene)-2,2,6-trimethyl-3-methylideneoxasilinane.

Molecular Properties

Compound Name(4E)-4-(2,2-dimethylpropylidene)-2,2,6-trimethyl-3-methylideneoxasilinane
PubChem CID134966621
Molecular FormulaC13H24OSi
Molecular Weight224.42 g/mol
Exact Mass224.16
IUPAC Name(4E)-4-(2,2-dimethylpropylidene)-2,2,6-trimethyl-3-methylideneoxasilinane
SMILESC=C1/C(=C/C(C)(C)C)CC(C)O[Si]1(C)C
InChIInChI=1S/C13H24OSi/c1-10-8-12(9-13(3,4)5)11(2)15(6,7)14-10/h9-10H,2,8H2,1,3-7H3/b12-9+
InChIKeyBDQALQOLLIWHTN-FMIVXFBMSA-N
XLogP4.07
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.42
LogP ≤ 54.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (4E)-4-(2,2-dimethylpropylidene)-2,2,6-trimethyl-3-methylideneoxasilinane?
The IUPAC name of (4E)-4-(2,2-dimethylpropylidene)-2,2,6-trimethyl-3-methylideneoxasilinane (CID 134966621) is (4E)-4-(2,2-dimethylpropylidene)-2,2,6-trimethyl-3-methylideneoxasilinane.
What is the SMILES notation for (4E)-4-(2,2-dimethylpropylidene)-2,2,6-trimethyl-3-methylideneoxasilinane?
The canonical SMILES for (4E)-4-(2,2-dimethylpropylidene)-2,2,6-trimethyl-3-methylideneoxasilinane is C=C1/C(=C/C(C)(C)C)CC(C)O[Si]1(C)C.
What is the InChIKey of (4E)-4-(2,2-dimethylpropylidene)-2,2,6-trimethyl-3-methylideneoxasilinane?
The InChIKey is BDQALQOLLIWHTN-FMIVXFBMSA-N. The full InChI is InChI=1S/C13H24OSi/c1-10-8-12(9-13(3,4)5)11(2)15(6,7)14-10/h9-10H,2,8H2,1,3-7H3/b12-9+.
What are the key properties of (4E)-4-(2,2-dimethylpropylidene)-2,2,6-trimethyl-3-methylideneoxasilinane?
(4E)-4-(2,2-dimethylpropylidene)-2,2,6-trimethyl-3-methylideneoxasilinane has a molecular weight of 224.42 g/mol, XLogP of 4.07, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4E)-4-(2,2-dimethylpropylidene)-2,2,6-trimethyl-3-methylideneoxasilinane is sourced from PubChem (CID 134966621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).