tert-butyl-dimethyl-(2-methyl-4-methylidene-5-pentyldecan-3-yl)oxysilane

C23H48OSi — CID 101421066

IUPACtert-butyl-dimethyl-(2-methyl-4-methylidene-5-pentyldecan-3-yl)oxysilane
SMILESC=C(C(CCCCC)CCCCC)C(O[Si](C)(C)C(C)(C)C)C(C)C
InChIInChI=1S/C23H48OSi/c1-11-13-15-17-21(18-16-14-12-2)20(5)22(19(3)4)24-25(9,10)23(6,7)8/h19,21-22H,5,11-18H2,1-4,6-10H3
InChIKeyMCEBILBAJSPOAO-UHFFFAOYSA-N
MW368.72 g/mol
LogP8.37
Rot. Bonds13

About tert-butyl-dimethyl-(2-methyl-4-methylidene-5-pentyldecan-3-yl)oxysilane

tert-butyl-dimethyl-(2-methyl-4-methylidene-5-pentyldecan-3-yl)oxysilane (PubChem CID 101421066) has the molecular formula C23H48OSi and a molecular weight of 368.72 g/mol. Its IUPAC name is tert-butyl-dimethyl-(2-methyl-4-methylidene-5-pentyldecan-3-yl)oxysilane.

Molecular Properties

Compound Nametert-butyl-dimethyl-(2-methyl-4-methylidene-5-pentyldecan-3-yl)oxysilane
PubChem CID101421066
Molecular FormulaC23H48OSi
Molecular Weight368.72 g/mol
Exact Mass368.35
IUPAC Nametert-butyl-dimethyl-(2-methyl-4-methylidene-5-pentyldecan-3-yl)oxysilane
SMILESC=C(C(CCCCC)CCCCC)C(O[Si](C)(C)C(C)(C)C)C(C)C
InChIInChI=1S/C23H48OSi/c1-11-13-15-17-21(18-16-14-12-2)20(5)22(19(3)4)24-25(9,10)23(6,7)8/h19,21-22H,5,11-18H2,1-4,6-10H3
InChIKeyMCEBILBAJSPOAO-UHFFFAOYSA-N
XLogP8.37
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds13
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.72
LogP ≤ 58.37
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-dimethyl-[(1S,2R,5R)-2-methyl-5-prop-1-en-2-ylcyclohexyl]oxysilane
CID 11021914
tert-butyl-dimethyl-[(3S,4R)-2-methyl-4-(2-methylprop-1-enyl)octan-3-yl]oxysilane
CID 11045214
tert-butyl-dimethyl-[(5S,6R)-6-(2-methylprop-1-enyl)decan-5-yl]oxysilane
CID 11077915
(1-Cyclohexyl-2-methylidenedodecoxy)-trimethylsilane
CID 44518239
[(E,1S)-1-cyclohexyl-2-ethylpent-2-enoxy]-triethylsilane
CID 102515909
[(E)-3-cyclohexyl-3-trimethylsilyloxyprop-1-enyl]-tri(propan-2-yl)silane
CID 134883124
Tert-butyl-(4-decyl-2-methylcyclopent-2-en-1-yl)oxy-dimethylsilane
CID 134905111
(2,2-Dimethyl-4-methylidenetetradecan-3-yl)oxy-trimethylsilane
CID 134942941
tert-butyl-dimethyl-[(3S,4S)-2-methyl-4-(2-methylprop-1-enyl)octan-3-yl]oxysilane
CID 134979489
tert-butyl-[(3R,4S)-4-ethenyl-2-methyloctan-3-yl]oxy-dimethylsilane
CID 134980552
[(1S)-1-cyclohexyl-2-methylideneoctoxy]-triethylsilane
CID 135000775
Tert-butyl-(5-hexyl-3-methylcyclopent-2-en-1-yl)oxy-dimethylsilane
CID 135070894

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-(2-methyl-4-methylidene-5-pentyldecan-3-yl)oxysilane?
The IUPAC name of tert-butyl-dimethyl-(2-methyl-4-methylidene-5-pentyldecan-3-yl)oxysilane (CID 101421066) is tert-butyl-dimethyl-(2-methyl-4-methylidene-5-pentyldecan-3-yl)oxysilane.
What is the SMILES notation for tert-butyl-dimethyl-(2-methyl-4-methylidene-5-pentyldecan-3-yl)oxysilane?
The canonical SMILES for tert-butyl-dimethyl-(2-methyl-4-methylidene-5-pentyldecan-3-yl)oxysilane is C=C(C(CCCCC)CCCCC)C(O[Si](C)(C)C(C)(C)C)C(C)C.
What is the InChIKey of tert-butyl-dimethyl-(2-methyl-4-methylidene-5-pentyldecan-3-yl)oxysilane?
The InChIKey is MCEBILBAJSPOAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H48OSi/c1-11-13-15-17-21(18-16-14-12-2)20(5)22(19(3)4)24-25(9,10)23(6,7)8/h19,21-22H,5,11-18H2,1-4,6-10H3.
What are the key properties of tert-butyl-dimethyl-(2-methyl-4-methylidene-5-pentyldecan-3-yl)oxysilane?
tert-butyl-dimethyl-(2-methyl-4-methylidene-5-pentyldecan-3-yl)oxysilane has a molecular weight of 368.72 g/mol, XLogP of 8.37, 13 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-(2-methyl-4-methylidene-5-pentyldecan-3-yl)oxysilane is sourced from PubChem (CID 101421066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).