ethenyl-heptoxy-methyl-propan-2-yloxysilane

C13H28O2Si — CID 91736458

IUPACethenyl-heptoxy-methyl-propan-2-yloxysilane
SMILESC=C[Si](C)(OCCCCCCC)OC(C)C
InChIInChI=1S/C13H28O2Si/c1-6-8-9-10-11-12-14-16(5,7-2)15-13(3)4/h7,13H,2,6,8-12H2,1,3-5H3
InChIKeyCNQULAKZPKYCBP-UHFFFAOYSA-N
MW244.45 g/mol
LogP4.20
Rot. Bonds10

About ethenyl-heptoxy-methyl-propan-2-yloxysilane

ethenyl-heptoxy-methyl-propan-2-yloxysilane (PubChem CID 91736458) has the molecular formula C13H28O2Si and a molecular weight of 244.45 g/mol. Its IUPAC name is ethenyl-heptoxy-methyl-propan-2-yloxysilane.

Molecular Properties

Compound Nameethenyl-heptoxy-methyl-propan-2-yloxysilane
PubChem CID91736458
Molecular FormulaC13H28O2Si
Molecular Weight244.45 g/mol
Exact Mass244.19
IUPAC Nameethenyl-heptoxy-methyl-propan-2-yloxysilane
SMILESC=C[Si](C)(OCCCCCCC)OC(C)C
InChIInChI=1S/C13H28O2Si/c1-6-8-9-10-11-12-14-16(5,7-2)15-13(3)4/h7,13H,2,6,8-12H2,1,3-5H3
InChIKeyCNQULAKZPKYCBP-UHFFFAOYSA-N
XLogP4.20
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.45
LogP ≤ 54.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Silane, dimethyl(2-heptyloxy)propoxy-
CID 91723694
Silane, methylvinyl(octyloxy)octyloxy-
CID 23105081
Silane, methylvinyl(dodecyloxy)dodecyloxy-
CID 87770809
Silane, methylvinyldi(hexyloxy)-
CID 91739110
Silane, methylvinyl(2-ethylhexyloxy)isopropoxy-
CID 91699095
Silane, methylvinyl(oct-4-yloxy)isopropoxy-
CID 91699097
Silane, dimethyl(2-octyloxy)ethoxy-
CID 91719383
Silane, monochloride, methylvinyl(hept-2-yloxy)-
CID 91720331
Silane, methylvinyl(pent-2-yloxy)ethoxy-
CID 91723233
Silane, methylvinyl(oct-2-yloxy)ethoxy-
CID 91723234
Silane, dimethyl(2-octyloxy)propoxy-
CID 91723691
Silane, methylvinyl(pent-2-yloxy)propoxy-
CID 91726227

Frequently Asked Questions

What is the IUPAC name of ethenyl-heptoxy-methyl-propan-2-yloxysilane?
The IUPAC name of ethenyl-heptoxy-methyl-propan-2-yloxysilane (CID 91736458) is ethenyl-heptoxy-methyl-propan-2-yloxysilane.
What is the SMILES notation for ethenyl-heptoxy-methyl-propan-2-yloxysilane?
The canonical SMILES for ethenyl-heptoxy-methyl-propan-2-yloxysilane is C=C[Si](C)(OCCCCCCC)OC(C)C.
What is the InChIKey of ethenyl-heptoxy-methyl-propan-2-yloxysilane?
The InChIKey is CNQULAKZPKYCBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28O2Si/c1-6-8-9-10-11-12-14-16(5,7-2)15-13(3)4/h7,13H,2,6,8-12H2,1,3-5H3.
What are the key properties of ethenyl-heptoxy-methyl-propan-2-yloxysilane?
ethenyl-heptoxy-methyl-propan-2-yloxysilane has a molecular weight of 244.45 g/mol, XLogP of 4.20, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethenyl-heptoxy-methyl-propan-2-yloxysilane is sourced from PubChem (CID 91736458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).