tert-butyl-dimethyl-(2-methylpentadec-1-en-3-yloxy)silane

C22H46OSi — CID 10594313

IUPACtert-butyl-dimethyl-(2-methylpentadec-1-en-3-yloxy)silane
SMILESC=C(C)C(CCCCCCCCCCCC)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C22H46OSi/c1-9-10-11-12-13-14-15-16-17-18-19-21(20(2)3)23-24(7,8)22(4,5)6/h21H,2,9-19H2,1,3-8H3
InChIKeyGYDDJNSDIWPCLD-UHFFFAOYSA-N
MW354.70 g/mol
LogP8.26
Rot. Bonds14

About tert-butyl-dimethyl-(2-methylpentadec-1-en-3-yloxy)silane

tert-butyl-dimethyl-(2-methylpentadec-1-en-3-yloxy)silane (PubChem CID 10594313) has the molecular formula C22H46OSi and a molecular weight of 354.70 g/mol. Its IUPAC name is tert-butyl-dimethyl-(2-methylpentadec-1-en-3-yloxy)silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-(2-methylpentadec-1-en-3-yloxy)silane
PubChem CID10594313
Molecular FormulaC22H46OSi
Molecular Weight354.70 g/mol
Exact Mass354.33
IUPAC Nametert-butyl-dimethyl-(2-methylpentadec-1-en-3-yloxy)silane
SMILESC=C(C)C(CCCCCCCCCCCC)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C22H46OSi/c1-9-10-11-12-13-14-15-16-17-18-19-21(20(2)3)23-24(7,8)22(4,5)6/h21H,2,9-19H2,1,3-8H3
InChIKeyGYDDJNSDIWPCLD-UHFFFAOYSA-N
XLogP8.26
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds14
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500354.70
LogP ≤ 58.26
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
Silane, (1,1-dimethylethyl)dimethyl(10-undecenyloxy)-
CID 10265922
Tert-butyl-(4,4-difluorodec-1-en-3-yloxy)-dimethylsilane
CID 140988825
trans-3-tert-Butyldimethylsilyloxy-1-tributylstannyl-1-octene
CID 10414672
Tert-butyl-dimethyl-(1-tributylstannyloct-1-en-3-yloxy)silane
CID 72836218
tert-butyl-dimethyl-[(4R)-undec-1-en-4-yl]oxysilane
CID 10850655
tert-butyl-[(E)-11-[dimethyl(propyl)silyl]undec-10-enoxy]-dimethylsilane
CID 16680055
12-Tridecen-2-yl trimethylsilyl ether
CID 100983019
Butoxy-dibutyl-(3-methylidenenonyl)silane
CID 101564536
tert-butyl-dimethyl-[(4R)-non-1-en-4-yl]oxysilane
CID 101808240
Tert-butyl-[2-[tert-butyl(dimethyl)silyl]oxy-1-ethenylheptoxy]-dimethylsilane
CID 101937867

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-(2-methylpentadec-1-en-3-yloxy)silane?
The IUPAC name of tert-butyl-dimethyl-(2-methylpentadec-1-en-3-yloxy)silane (CID 10594313) is tert-butyl-dimethyl-(2-methylpentadec-1-en-3-yloxy)silane.
What is the SMILES notation for tert-butyl-dimethyl-(2-methylpentadec-1-en-3-yloxy)silane?
The canonical SMILES for tert-butyl-dimethyl-(2-methylpentadec-1-en-3-yloxy)silane is C=C(C)C(CCCCCCCCCCCC)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-(2-methylpentadec-1-en-3-yloxy)silane?
The InChIKey is GYDDJNSDIWPCLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H46OSi/c1-9-10-11-12-13-14-15-16-17-18-19-21(20(2)3)23-24(7,8)22(4,5)6/h21H,2,9-19H2,1,3-8H3.
What are the key properties of tert-butyl-dimethyl-(2-methylpentadec-1-en-3-yloxy)silane?
tert-butyl-dimethyl-(2-methylpentadec-1-en-3-yloxy)silane has a molecular weight of 354.70 g/mol, XLogP of 8.26, 14 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-(2-methylpentadec-1-en-3-yloxy)silane is sourced from PubChem (CID 10594313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).