[diacetyloxy(oct-7-enyl)silyl] acetate

C14H24O6Si — CID 145259170

IUPAC[diacetyloxy(oct-7-enyl)silyl] acetate
SMILESC=CCCCCCC[Si](OC(C)=O)(OC(C)=O)OC(C)=O
InChIInChI=1S/C14H24O6Si/c1-5-6-7-8-9-10-11-21(18-12(2)15,19-13(3)16)20-14(4)17/h5H,1,6-11H2,2-4H3
InChIKeyUIVZXSOKZZGBBL-UHFFFAOYSA-N
MW316.43 g/mol
LogP2.75
Rot. Bonds10

About [diacetyloxy(oct-7-enyl)silyl] acetate

[diacetyloxy(oct-7-enyl)silyl] acetate (PubChem CID 145259170) has the molecular formula C14H24O6Si and a molecular weight of 316.43 g/mol. Its IUPAC name is [diacetyloxy(oct-7-enyl)silyl] acetate.

Molecular Properties

Compound Name[diacetyloxy(oct-7-enyl)silyl] acetate
PubChem CID145259170
Molecular FormulaC14H24O6Si
Molecular Weight316.43 g/mol
Exact Mass316.13
IUPAC Name[diacetyloxy(oct-7-enyl)silyl] acetate
SMILESC=CCCCCCC[Si](OC(C)=O)(OC(C)=O)OC(C)=O
InChIInChI=1S/C14H24O6Si/c1-5-6-7-8-9-10-11-21(18-12(2)15,19-13(3)16)20-14(4)17/h5H,1,6-11H2,2-4H3
InChIKeyUIVZXSOKZZGBBL-UHFFFAOYSA-N
XLogP2.75
TPSA78.90 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.43
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

[diacetyloxy(butyl)silyl] acetate;prop-2-enamide
CID 158770518
nonadec-18-enyl acetate
CID 87443633
pentadec-14-enyl acetate
CID 87443745
tris(methylsilyloxy)-oct-7-enylsilane
CID 123850112
hex-5-enyl acetate
CID 537536
docos-21-enyl-dihydroxy-methoxysilane
CID 123262992
3-triacetyloxysilylpropyl but-2-enoate
CID 57008855
ethoxy-hexadec-15-enyl-dimethoxysilane
CID 87214510
nonacosa-1,28-dien-15-yl acetate
CID 101064980
diethoxy-methoxy-oct-7-enylsilane
CID 87214506
bis(dodec-11-enyl)-dimethylsilane
CID 171781898
[acetyloxy-[8-[diacetyloxy(methyl)silyl]octyl]-methylsilyl] acetate
CID 154117413

Frequently Asked Questions

What is the IUPAC name of [diacetyloxy(oct-7-enyl)silyl] acetate?
The IUPAC name of [diacetyloxy(oct-7-enyl)silyl] acetate (CID 145259170) is [diacetyloxy(oct-7-enyl)silyl] acetate.
What is the SMILES notation for [diacetyloxy(oct-7-enyl)silyl] acetate?
The canonical SMILES for [diacetyloxy(oct-7-enyl)silyl] acetate is C=CCCCCCC[Si](OC(C)=O)(OC(C)=O)OC(C)=O.
What is the InChIKey of [diacetyloxy(oct-7-enyl)silyl] acetate?
The InChIKey is UIVZXSOKZZGBBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O6Si/c1-5-6-7-8-9-10-11-21(18-12(2)15,19-13(3)16)20-14(4)17/h5H,1,6-11H2,2-4H3.
What are the key properties of [diacetyloxy(oct-7-enyl)silyl] acetate?
[diacetyloxy(oct-7-enyl)silyl] acetate has a molecular weight of 316.43 g/mol, XLogP of 2.75, 10 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [diacetyloxy(oct-7-enyl)silyl] acetate is sourced from PubChem (CID 145259170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).