trimethyl-[1-(oxiren-2-yl)hept-1-en-3-yloxy]silane

C12H22O2Si — CID 57221185

IUPACtrimethyl-[1-(oxiren-2-yl)hept-1-en-3-yloxy]silane
SMILESCCCCC(C=CC1=CO1)O[Si](C)(C)C
InChIInChI=1S/C12H22O2Si/c1-5-6-7-11(14-15(2,3)4)8-9-12-10-13-12/h8-11H,5-7H2,1-4H3
InChIKeyVLXMWOOPVTZYII-UHFFFAOYSA-N
MW226.39 g/mol
LogP3.82
Rot. Bonds7

About trimethyl-[1-(oxiren-2-yl)hept-1-en-3-yloxy]silane

trimethyl-[1-(oxiren-2-yl)hept-1-en-3-yloxy]silane (PubChem CID 57221185) has the molecular formula C12H22O2Si and a molecular weight of 226.39 g/mol. Its IUPAC name is trimethyl-[1-(oxiren-2-yl)hept-1-en-3-yloxy]silane.

Molecular Properties

Compound Nametrimethyl-[1-(oxiren-2-yl)hept-1-en-3-yloxy]silane
PubChem CID57221185
Molecular FormulaC12H22O2Si
Molecular Weight226.39 g/mol
Exact Mass226.14
IUPAC Nametrimethyl-[1-(oxiren-2-yl)hept-1-en-3-yloxy]silane
SMILESCCCCC(C=CC1=CO1)O[Si](C)(C)C
InChIInChI=1S/C12H22O2Si/c1-5-6-7-11(14-15(2,3)4)8-9-12-10-13-12/h8-11H,5-7H2,1-4H3
InChIKeyVLXMWOOPVTZYII-UHFFFAOYSA-N
XLogP3.82
TPSA21.76 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.39
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl-[(Z)-4-methoxyoct-2-enoxy]-dimethylsilane
CID 11529167
Trimethyl-[1-(oxiren-2-yl)non-1-en-3-yloxy]silane
CID 56995007
Trimethyl-[1-(oxiren-2-yl)oct-1-en-3-yloxy]silane
CID 57093918
Trimethyl-[1-(oxiren-2-yl)dec-1-en-3-yloxy]silane
CID 57248025
Trimethyl(nona-1,3-dien-5-yloxy)silane
CID 140333730
(2-Ethyl-5-prop-2-enoxycyclohexa-1,5-dien-1-yl)oxy-trimethylsilane
CID 10753345
(3-Methoxycyclopenta-1,4-dien-1-yl)oxy-trimethylsilane
CID 141582517

Frequently Asked Questions

What is the IUPAC name of trimethyl-[1-(oxiren-2-yl)hept-1-en-3-yloxy]silane?
The IUPAC name of trimethyl-[1-(oxiren-2-yl)hept-1-en-3-yloxy]silane (CID 57221185) is trimethyl-[1-(oxiren-2-yl)hept-1-en-3-yloxy]silane.
What is the SMILES notation for trimethyl-[1-(oxiren-2-yl)hept-1-en-3-yloxy]silane?
The canonical SMILES for trimethyl-[1-(oxiren-2-yl)hept-1-en-3-yloxy]silane is CCCCC(C=CC1=CO1)O[Si](C)(C)C.
What is the InChIKey of trimethyl-[1-(oxiren-2-yl)hept-1-en-3-yloxy]silane?
The InChIKey is VLXMWOOPVTZYII-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22O2Si/c1-5-6-7-11(14-15(2,3)4)8-9-12-10-13-12/h8-11H,5-7H2,1-4H3.
What are the key properties of trimethyl-[1-(oxiren-2-yl)hept-1-en-3-yloxy]silane?
trimethyl-[1-(oxiren-2-yl)hept-1-en-3-yloxy]silane has a molecular weight of 226.39 g/mol, XLogP of 3.82, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[1-(oxiren-2-yl)hept-1-en-3-yloxy]silane is sourced from PubChem (CID 57221185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).