tert-butyl-dimethyl-[(Z)-octadec-9-en-6-yl]oxysilane

C24H50OSi — CID 134866255

IUPACtert-butyl-dimethyl-[(Z)-octadec-9-en-6-yl]oxysilane
SMILESCCCCCCCC/C=C\CCC(CCCCC)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C24H50OSi/c1-8-10-12-13-14-15-16-17-18-20-22-23(21-19-11-9-2)25-26(6,7)24(3,4)5/h17-18,23H,8-16,19-22H2,1-7H3/b18-17-
InChIKeyIVJCCJAHRZYWBU-ZCXUNETKSA-N
MW382.75 g/mol
LogP9.04
Rot. Bonds16

About tert-butyl-dimethyl-[(Z)-octadec-9-en-6-yl]oxysilane

tert-butyl-dimethyl-[(Z)-octadec-9-en-6-yl]oxysilane (PubChem CID 134866255) has the molecular formula C24H50OSi and a molecular weight of 382.75 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(Z)-octadec-9-en-6-yl]oxysilane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(Z)-octadec-9-en-6-yl]oxysilane
PubChem CID134866255
Molecular FormulaC24H50OSi
Molecular Weight382.75 g/mol
Exact Mass382.36
IUPAC Nametert-butyl-dimethyl-[(Z)-octadec-9-en-6-yl]oxysilane
SMILESCCCCCCCC/C=C\CCC(CCCCC)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C24H50OSi/c1-8-10-12-13-14-15-16-17-18-20-22-23(21-19-11-9-2)25-26(6,7)24(3,4)5/h17-18,23H,8-16,19-22H2,1-7H3/b18-17-
InChIKeyIVJCCJAHRZYWBU-ZCXUNETKSA-N
XLogP9.04
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds16
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500382.75
LogP ≤ 59.04
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'}

Analyze tert-butyl-dimethyl-[(Z)-octadec-9-en-6-yl]oxysilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Silane, (1,1-dimethylethyl)[(1-ethenylhexyl)oxy]dimethyl-
CID 9986037
Tert-butyl(dec-9-enyloxy)dimethylsilane
CID 10869380
1-Nonen-3-ol, tert-butyldimethylsilyl ether
CID 10868924
1-Triethylsilyloxyundec-10-ene
CID 568575
Octadec-9Z-enol trimethylsilyl ether
CID 5366884
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
Linoleyl alcohol tms ether
CID 15635192
7,12-Bis(trimethylsiloxy)octadec-9-ene
CID 91341822
Trimethyl((9Z,11E)-9,11-tetradecadien-1-yloxy)silane
CID 20838897
1-Fluorodec-2-en-5-yloxy(trimethyl)silane
CID 140328261

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[(Z)-octadec-9-en-6-yl]oxysilane?
The IUPAC name of tert-butyl-dimethyl-[(Z)-octadec-9-en-6-yl]oxysilane (CID 134866255) is tert-butyl-dimethyl-[(Z)-octadec-9-en-6-yl]oxysilane.
What is the SMILES notation for tert-butyl-dimethyl-[(Z)-octadec-9-en-6-yl]oxysilane?
The canonical SMILES for tert-butyl-dimethyl-[(Z)-octadec-9-en-6-yl]oxysilane is CCCCCCCC/C=C\CCC(CCCCC)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-[(Z)-octadec-9-en-6-yl]oxysilane?
The InChIKey is IVJCCJAHRZYWBU-ZCXUNETKSA-N. The full InChI is InChI=1S/C24H50OSi/c1-8-10-12-13-14-15-16-17-18-20-22-23(21-19-11-9-2)25-26(6,7)24(3,4)5/h17-18,23H,8-16,19-22H2,1-7H3/b18-17-.
What are the key properties of tert-butyl-dimethyl-[(Z)-octadec-9-en-6-yl]oxysilane?
tert-butyl-dimethyl-[(Z)-octadec-9-en-6-yl]oxysilane has a molecular weight of 382.75 g/mol, XLogP of 9.04, 16 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(Z)-octadec-9-en-6-yl]oxysilane is sourced from PubChem (CID 134866255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).