tert-butyl-dimethyl-[(7Z,9E)-pentadeca-7,9-dien-6-yl]oxysilane

C21H42OSi — CID 10925811

IUPACtert-butyl-dimethyl-[(7Z,9E)-pentadeca-7,9-dien-6-yl]oxysilane
SMILESCCCCC/C=C/C=C\C(CCCCC)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C21H42OSi/c1-8-10-12-13-14-15-17-19-20(18-16-11-9-2)22-23(6,7)21(3,4)5/h14-15,17,19-20H,8-13,16,18H2,1-7H3/b15-14+,19-17-
InChIKeyNYYTUZKABUXADJ-GMXJTBKTSA-N
MW338.65 g/mol
LogP7.65
Rot. Bonds12

About tert-butyl-dimethyl-[(7Z,9E)-pentadeca-7,9-dien-6-yl]oxysilane

tert-butyl-dimethyl-[(7Z,9E)-pentadeca-7,9-dien-6-yl]oxysilane (PubChem CID 10925811) has the molecular formula C21H42OSi and a molecular weight of 338.65 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(7Z,9E)-pentadeca-7,9-dien-6-yl]oxysilane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(7Z,9E)-pentadeca-7,9-dien-6-yl]oxysilane
PubChem CID10925811
Molecular FormulaC21H42OSi
Molecular Weight338.65 g/mol
Exact Mass338.30
IUPAC Nametert-butyl-dimethyl-[(7Z,9E)-pentadeca-7,9-dien-6-yl]oxysilane
SMILESCCCCC/C=C/C=C\C(CCCCC)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C21H42OSi/c1-8-10-12-13-14-15-17-19-20(18-16-11-9-2)22-23(6,7)21(3,4)5/h14-15,17,19-20H,8-13,16,18H2,1-7H3/b15-14+,19-17-
InChIKeyNYYTUZKABUXADJ-GMXJTBKTSA-N
XLogP7.65
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds12
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.65
LogP ≤ 57.65
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': 'polyene', 'substructure': 'N/A'}

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Related Compounds

(9s,5z,7e)-9-t-Butyldimethylsilyloxy-5,7-decadienol
CID 129706267
(9s,5e,7e)-9-t-Butyldimethylsilyloxy-5,7-decadienol
CID 129706328
tert-Butyl(cyclohex-2-enyloxy)dimethylsilane
CID 11085130
Cyclohept-2-en-1-yloxy(trimethyl)silane
CID 12504316
tert-Butyl-((S)-3-isopropenyl-cyclopent-2-enyloxy)-dimethyl-silane
CID 57386254
2-Dimethyloctylsilyloxyoct-3-ene
CID 5353190
2-Trihexylsilyloxyoct-3-ene
CID 5353195
2-Dimethyldodecylsilyloxyoct-3-ene
CID 5353202
Silane, dimethyl(oct-3-en-2-yloxy)octyloxy-
CID 91739055
Silane, dimethyl(oct-3-en-2-yloxy)decyloxy-
CID 91740946
trans-3-tert-Butyldimethylsilyloxy-1-tributylstannyl-1-octene
CID 10414672
Tert-butyl-dimethyl-(1-tributylstannyloct-1-en-3-yloxy)silane
CID 72836218

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[(7Z,9E)-pentadeca-7,9-dien-6-yl]oxysilane?
The IUPAC name of tert-butyl-dimethyl-[(7Z,9E)-pentadeca-7,9-dien-6-yl]oxysilane (CID 10925811) is tert-butyl-dimethyl-[(7Z,9E)-pentadeca-7,9-dien-6-yl]oxysilane.
What is the SMILES notation for tert-butyl-dimethyl-[(7Z,9E)-pentadeca-7,9-dien-6-yl]oxysilane?
The canonical SMILES for tert-butyl-dimethyl-[(7Z,9E)-pentadeca-7,9-dien-6-yl]oxysilane is CCCCC/C=C/C=C\C(CCCCC)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-[(7Z,9E)-pentadeca-7,9-dien-6-yl]oxysilane?
The InChIKey is NYYTUZKABUXADJ-GMXJTBKTSA-N. The full InChI is InChI=1S/C21H42OSi/c1-8-10-12-13-14-15-17-19-20(18-16-11-9-2)22-23(6,7)21(3,4)5/h14-15,17,19-20H,8-13,16,18H2,1-7H3/b15-14+,19-17-.
What are the key properties of tert-butyl-dimethyl-[(7Z,9E)-pentadeca-7,9-dien-6-yl]oxysilane?
tert-butyl-dimethyl-[(7Z,9E)-pentadeca-7,9-dien-6-yl]oxysilane has a molecular weight of 338.65 g/mol, XLogP of 7.65, 12 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(7Z,9E)-pentadeca-7,9-dien-6-yl]oxysilane is sourced from PubChem (CID 10925811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).