tert-butyl-dimethyl-tetradec-13-enoxysilane

C20H42OSi — CID 135017180

IUPACtert-butyl-dimethyl-tetradec-13-enoxysilane
SMILESC=CCCCCCCCCCCCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C20H42OSi/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-21-22(5,6)20(2,3)4/h7H,1,8-19H2,2-6H3
InChIKeyMVWIXTJSUDIPRN-UHFFFAOYSA-N
MW326.64 g/mol
LogP7.49
Rot. Bonds14

About tert-butyl-dimethyl-tetradec-13-enoxysilane

tert-butyl-dimethyl-tetradec-13-enoxysilane (PubChem CID 135017180) has the molecular formula C20H42OSi and a molecular weight of 326.64 g/mol. Its IUPAC name is tert-butyl-dimethyl-tetradec-13-enoxysilane.

Molecular Properties

Compound Nametert-butyl-dimethyl-tetradec-13-enoxysilane
PubChem CID135017180
Molecular FormulaC20H42OSi
Molecular Weight326.64 g/mol
Exact Mass326.30
IUPAC Nametert-butyl-dimethyl-tetradec-13-enoxysilane
SMILESC=CCCCCCCCCCCCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C20H42OSi/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-21-22(5,6)20(2,3)4/h7H,1,8-19H2,2-6H3
InChIKeyMVWIXTJSUDIPRN-UHFFFAOYSA-N
XLogP7.49
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds14
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500326.64
LogP ≤ 57.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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

Tert-butyl(dec-9-enyloxy)dimethylsilane
CID 10869380
1-Nonen-3-ol, tert-butyldimethylsilyl ether
CID 10868924
Trimethyl(undec-10-enoxy)silane
CID 554429
1-Triethylsilyloxyundec-10-ene
CID 568575
Octadec-9Z-enol trimethylsilyl ether
CID 5366884
9-Decen-1-ol, TMS derivative
CID 12578077
tert-butyl-dimethyl-[(E)-12,12,12-trifluorododec-9-enoxy]silane
CID 14521703
Trimethyl(9-octadecenyloxy)-silane
CID 554435
Silane, (1,1-dimethylethyl)dimethyl(10-undecenyloxy)-
CID 10265922
tert-butyl-[(E)-dec-1-enoxy]-dimethylsilane
CID 11065530
Linoleyl alcohol tms ether
CID 15635192
Trimethyl((9Z,11E)-9,11-tetradecadien-1-yloxy)silane
CID 20838897

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-tetradec-13-enoxysilane?
The IUPAC name of tert-butyl-dimethyl-tetradec-13-enoxysilane (CID 135017180) is tert-butyl-dimethyl-tetradec-13-enoxysilane.
What is the SMILES notation for tert-butyl-dimethyl-tetradec-13-enoxysilane?
The canonical SMILES for tert-butyl-dimethyl-tetradec-13-enoxysilane is C=CCCCCCCCCCCCCO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-tetradec-13-enoxysilane?
The InChIKey is MVWIXTJSUDIPRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H42OSi/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-21-22(5,6)20(2,3)4/h7H,1,8-19H2,2-6H3.
What are the key properties of tert-butyl-dimethyl-tetradec-13-enoxysilane?
tert-butyl-dimethyl-tetradec-13-enoxysilane has a molecular weight of 326.64 g/mol, XLogP of 7.49, 14 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-tetradec-13-enoxysilane is sourced from PubChem (CID 135017180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).