tert-butyl-dimethyl-[(Z)-4-methylidene-1-phenyldec-5-en-3-yl]oxysilane

C23H38OSi — CID 11199157

IUPACtert-butyl-dimethyl-[(Z)-4-methylidene-1-phenyldec-5-en-3-yl]oxysilane
SMILESC=C(/C=C\CCCC)C(CCc1ccccc1)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C23H38OSi/c1-8-9-10-12-15-20(2)22(24-25(6,7)23(3,4)5)19-18-21-16-13-11-14-17-21/h11-17,22H,2,8-10,18-19H2,1,3-7H3/b15-12-
InChIKeyQGTHXOPPNKVOPQ-QINSGFPZSA-N
MW358.64 g/mol
LogP7.31
Rot. Bonds10

About tert-butyl-dimethyl-[(Z)-4-methylidene-1-phenyldec-5-en-3-yl]oxysilane

tert-butyl-dimethyl-[(Z)-4-methylidene-1-phenyldec-5-en-3-yl]oxysilane (PubChem CID 11199157) has the molecular formula C23H38OSi and a molecular weight of 358.64 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(Z)-4-methylidene-1-phenyldec-5-en-3-yl]oxysilane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(Z)-4-methylidene-1-phenyldec-5-en-3-yl]oxysilane
PubChem CID11199157
Molecular FormulaC23H38OSi
Molecular Weight358.64 g/mol
Exact Mass358.27
IUPAC Nametert-butyl-dimethyl-[(Z)-4-methylidene-1-phenyldec-5-en-3-yl]oxysilane
SMILESC=C(/C=C\CCCC)C(CCc1ccccc1)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C23H38OSi/c1-8-9-10-12-15-20(2)22(24-25(6,7)23(3,4)5)19-18-21-16-13-11-14-17-21/h11-17,22H,2,8-10,18-19H2,1,3-7H3/b15-12-
InChIKeyQGTHXOPPNKVOPQ-QINSGFPZSA-N
XLogP7.31
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.64
LogP ≤ 57.31
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

[3-[tert-butyl(dimethyl)silyl]oxy-2-methylidene-5-phenylpentyl] acetate
CID 11163883
(2R)-2-[tert-butyl(dimethyl)silyl]oxy-4-phenylbutan-1-ol
CID 139246891
(3S,4S)-4-[tert-butyl(dimethyl)silyl]oxy-1-phenylpentan-3-ol
CID 57308546
(2S,3S)-3-[tert-butyl(dimethyl)silyl]oxy-5-phenylpentan-2-ol
CID 67144308
dimethyl-[(3E)-octa-1,3-dien-2-yl]oxy-phenylsilane
CID 102299018
tert-butyl-dimethyl-[(2S)-3-methylidene-5-phenylpentan-2-yl]oxysilane
CID 101349147
[(6Z)-11-[tert-butyl(dimethyl)silyl]oxy-12-cyano-5-methylidenetrideca-6,12-dien-4-yl] acetate
CID 102399529
(2R,3S)-3-[tert-butyl(dimethyl)silyl]oxy-2-methyl-5-phenylpentanal
CID 53259150
(2S)-2-[[(2R)-2-[tert-butyl(dimethyl)silyl]oxy-4-phenylbutanoyl]amino]-3-methylbutanoic acid
CID 70085517
tert-butyl-dimethyl-[(Z)-1-phenyloct-5-en-3-yl]oxysilane;carbon dioxide
CID 158278224
(3-methoxy-4-methylideneoctyl)benzene
CID 71375436
ethyl (E,5R)-5-[tert-butyl(dimethyl)silyl]oxy-9-phenylnon-2-enoate
CID 134835436

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[(Z)-4-methylidene-1-phenyldec-5-en-3-yl]oxysilane?
The IUPAC name of tert-butyl-dimethyl-[(Z)-4-methylidene-1-phenyldec-5-en-3-yl]oxysilane (CID 11199157) is tert-butyl-dimethyl-[(Z)-4-methylidene-1-phenyldec-5-en-3-yl]oxysilane.
What is the SMILES notation for tert-butyl-dimethyl-[(Z)-4-methylidene-1-phenyldec-5-en-3-yl]oxysilane?
The canonical SMILES for tert-butyl-dimethyl-[(Z)-4-methylidene-1-phenyldec-5-en-3-yl]oxysilane is C=C(/C=C\CCCC)C(CCc1ccccc1)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-[(Z)-4-methylidene-1-phenyldec-5-en-3-yl]oxysilane?
The InChIKey is QGTHXOPPNKVOPQ-QINSGFPZSA-N. The full InChI is InChI=1S/C23H38OSi/c1-8-9-10-12-15-20(2)22(24-25(6,7)23(3,4)5)19-18-21-16-13-11-14-17-21/h11-17,22H,2,8-10,18-19H2,1,3-7H3/b15-12-.
What are the key properties of tert-butyl-dimethyl-[(Z)-4-methylidene-1-phenyldec-5-en-3-yl]oxysilane?
tert-butyl-dimethyl-[(Z)-4-methylidene-1-phenyldec-5-en-3-yl]oxysilane has a molecular weight of 358.64 g/mol, XLogP of 7.31, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(Z)-4-methylidene-1-phenyldec-5-en-3-yl]oxysilane is sourced from PubChem (CID 11199157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).