tripropyl(tridec-2-ynoxy)silane

C22H44OSi — CID 531311

IUPACtripropyl(tridec-2-ynoxy)silane
SMILESCCCCCCCCCCC#CCO[Si](CCC)(CCC)CCC
InChIInChI=1S/C22H44OSi/c1-5-9-10-11-12-13-14-15-16-17-18-19-23-24(20-6-2,21-7-3)22-8-4/h5-16,19-22H2,1-4H3
InChIKeyUQROCPWGUGCWNX-UHFFFAOYSA-N
MW352.68 g/mol
LogP7.71
Rot. Bonds16

About tripropyl(tridec-2-ynoxy)silane

tripropyl(tridec-2-ynoxy)silane (PubChem CID 531311) has the molecular formula C22H44OSi and a molecular weight of 352.68 g/mol. Its IUPAC name is tripropyl(tridec-2-ynoxy)silane.

Molecular Properties

Compound Nametripropyl(tridec-2-ynoxy)silane
PubChem CID531311
Molecular FormulaC22H44OSi
Molecular Weight352.68 g/mol
Exact Mass352.32
IUPAC Nametripropyl(tridec-2-ynoxy)silane
SMILESCCCCCCCCCCC#CCO[Si](CCC)(CCC)CCC
InChIInChI=1S/C22H44OSi/c1-5-9-10-11-12-13-14-15-16-17-18-19-23-24(20-6-2,21-7-3)22-8-4/h5-16,19-22H2,1-4H3
InChIKeyUQROCPWGUGCWNX-UHFFFAOYSA-N
XLogP7.71
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds16
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500352.68
LogP ≤ 57.71
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': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

Diethoxymethyloctadecylsilane
CID 105838
Silane, dodecyldiethoxymethyl-
CID 108922
Dimethyldodecylsilyloxyethane
CID 531757
1-(Dimethyldodecylsilyloxy)butane
CID 531758
Didecyldiethoxysilane
CID 21688959
Dinonyldiethoxysilane
CID 90258978
Didecylethoxy-silane
CID 129808903
But-2-ynoxy-oct-1-ynyl-di(propan-2-yl)silane
CID 23777790
1-Triisobutylsilyloxytridec-2-yne
CID 531267
1-Trimethylsilyloxytridec-2-yne
CID 531274
1-Dimethylisopropylsilyloxytridec-2-yne
CID 531293
2-Dimethyloctylsilyloxybut-3-yne
CID 531295

Frequently Asked Questions

What is the IUPAC name of tripropyl(tridec-2-ynoxy)silane?
The IUPAC name of tripropyl(tridec-2-ynoxy)silane (CID 531311) is tripropyl(tridec-2-ynoxy)silane.
What is the SMILES notation for tripropyl(tridec-2-ynoxy)silane?
The canonical SMILES for tripropyl(tridec-2-ynoxy)silane is CCCCCCCCCCC#CCO[Si](CCC)(CCC)CCC.
What is the InChIKey of tripropyl(tridec-2-ynoxy)silane?
The InChIKey is UQROCPWGUGCWNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H44OSi/c1-5-9-10-11-12-13-14-15-16-17-18-19-23-24(20-6-2,21-7-3)22-8-4/h5-16,19-22H2,1-4H3.
What are the key properties of tripropyl(tridec-2-ynoxy)silane?
tripropyl(tridec-2-ynoxy)silane has a molecular weight of 352.68 g/mol, XLogP of 7.71, 16 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tripropyl(tridec-2-ynoxy)silane is sourced from PubChem (CID 531311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).