tert-butyl-dimethyl-[1-(1-propylcyclobutyl)but-3-ynoxy]silane

C17H32OSi — CID 15475299

IUPACtert-butyl-dimethyl-[1-(1-propylcyclobutyl)but-3-ynoxy]silane
SMILESC#CCC(O[Si](C)(C)C(C)(C)C)C1(CCC)CCC1
InChIInChI=1S/C17H32OSi/c1-8-11-15(17(12-9-2)13-10-14-17)18-19(6,7)16(3,4)5/h1,15H,9-14H2,2-7H3
InChIKeyUNRXEMQBSHJQBB-UHFFFAOYSA-N
MW280.53 g/mol
LogP5.37
Rot. Bonds6

About tert-butyl-dimethyl-[1-(1-propylcyclobutyl)but-3-ynoxy]silane

tert-butyl-dimethyl-[1-(1-propylcyclobutyl)but-3-ynoxy]silane (PubChem CID 15475299) has the molecular formula C17H32OSi and a molecular weight of 280.53 g/mol. Its IUPAC name is tert-butyl-dimethyl-[1-(1-propylcyclobutyl)but-3-ynoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[1-(1-propylcyclobutyl)but-3-ynoxy]silane
PubChem CID15475299
Molecular FormulaC17H32OSi
Molecular Weight280.53 g/mol
Exact Mass280.22
IUPAC Nametert-butyl-dimethyl-[1-(1-propylcyclobutyl)but-3-ynoxy]silane
SMILESC#CCC(O[Si](C)(C)C(C)(C)C)C1(CCC)CCC1
InChIInChI=1S/C17H32OSi/c1-8-11-15(17(12-9-2)13-10-14-17)18-19(6,7)16(3,4)5/h1,15H,9-14H2,2-7H3
InChIKeyUNRXEMQBSHJQBB-UHFFFAOYSA-N
XLogP5.37
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500280.53
LogP ≤ 55.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

(E)-5-[tert-butyl(dimethyl)silyl]oxy-5-(1-propylcyclobutyl)pent-2-en-1-ol
CID 67102119
tert-butyl-dimethyl-pent-4-yn-2-yloxysilane
CID 588048
tert-butyl-dimethyl-[(4S)-oct-1-yn-4-yl]oxysilane
CID 129405343
4-(1-butylcyclobutyl)-4-[tert-butyl(dimethyl)silyl]oxybut-2-yn-1-ol
CID 66993804
(3R)-3-[tert-butyl(dimethyl)silyl]oxyhex-5-ynal
CID 11218406
tert-butyl-[(1R)-1-[(4S,5S)-5-[(1R)-1-[tert-butyl(dimethyl)silyl]oxybut-3-ynyl]-2,2-dimethyl-1,3-dioxolan-4-yl]but-3-ynoxy]-dimethylsilane
CID 11442711
tert-butyl-dimethyl-[(1-prop-2-ynylcyclobutyl)methoxy]silane
CID 165342832
(4S,6R)-6-[tert-butyl(dimethyl)silyl]oxytridec-1-yn-4-ol
CID 57407601
tert-butyl-dimethyl-(1-phenylhex-5-yn-3-yloxy)silane
CID 139249096
tert-butyl-[(3S,4R)-3-[tert-butyl(dimethyl)silyl]oxy-4-methylhept-6-ynoxy]-dimethylsilane
CID 11773114
tert-butyl-dimethyl-(4-methyl-1-propylcyclohexyl)oxysilane
CID 70179351
(3R,4S,5R)-3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-N,N-diethyloct-1-en-7-yn-4-amine
CID 70678065

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[1-(1-propylcyclobutyl)but-3-ynoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[1-(1-propylcyclobutyl)but-3-ynoxy]silane (CID 15475299) is tert-butyl-dimethyl-[1-(1-propylcyclobutyl)but-3-ynoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[1-(1-propylcyclobutyl)but-3-ynoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[1-(1-propylcyclobutyl)but-3-ynoxy]silane is C#CCC(O[Si](C)(C)C(C)(C)C)C1(CCC)CCC1.
What is the InChIKey of tert-butyl-dimethyl-[1-(1-propylcyclobutyl)but-3-ynoxy]silane?
The InChIKey is UNRXEMQBSHJQBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32OSi/c1-8-11-15(17(12-9-2)13-10-14-17)18-19(6,7)16(3,4)5/h1,15H,9-14H2,2-7H3.
What are the key properties of tert-butyl-dimethyl-[1-(1-propylcyclobutyl)but-3-ynoxy]silane?
tert-butyl-dimethyl-[1-(1-propylcyclobutyl)but-3-ynoxy]silane has a molecular weight of 280.53 g/mol, XLogP of 5.37, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[1-(1-propylcyclobutyl)but-3-ynoxy]silane is sourced from PubChem (CID 15475299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).