9-[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxynon-4-yn-1-ol

C17H34O2Si — CID 22164928

IUPAC9-[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxynon-4-yn-1-ol
SMILESCC(C)C(C)(C)[Si](C)(C)OCCCCC#CCCCO
InChIInChI=1S/C17H34O2Si/c1-16(2)17(3,4)20(5,6)19-15-13-11-9-7-8-10-12-14-18/h16,18H,9-15H2,1-6H3
InChIKeyGVUQZJLMHLOPPK-UHFFFAOYSA-N
MW298.54 g/mol
LogP4.59
Rot. Bonds9

About 9-[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxynon-4-yn-1-ol

9-[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxynon-4-yn-1-ol (PubChem CID 22164928) has the molecular formula C17H34O2Si and a molecular weight of 298.54 g/mol. Its IUPAC name is 9-[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxynon-4-yn-1-ol.

Molecular Properties

Compound Name9-[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxynon-4-yn-1-ol
PubChem CID22164928
Molecular FormulaC17H34O2Si
Molecular Weight298.54 g/mol
Exact Mass298.23
IUPAC Name9-[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxynon-4-yn-1-ol
SMILESCC(C)C(C)(C)[Si](C)(C)OCCCCC#CCCCO
InChIInChI=1S/C17H34O2Si/c1-16(2)17(3,4)20(5,6)19-15-13-11-9-7-8-10-12-14-18/h16,18H,9-15H2,1-6H3
InChIKeyGVUQZJLMHLOPPK-UHFFFAOYSA-N
XLogP4.59
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.54
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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

5-[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxypent-2-yn-1-ol
CID 10399504
tert-butyl-hex-5-ynoxy-dimethylsilane;hex-5-yn-1-ol
CID 158514976
22-[tert-butyl(dimethyl)silyl]oxydocosan-1-ol
CID 15229755
8-[tert-butyl(dimethyl)silyl]oxyoctan-1-ol
CID 11043515
tert-butyl-(7-iodohept-6-ynoxy)-dimethylsilane
CID 87614781
13-bromotridec-12-ynoxy-tert-butyl-dimethylsilane
CID 11222996
tert-butyl-dimethyl-[7-[(2R)-oxiran-2-yl]hept-5-ynoxy]silane
CID 54672543
13-[tert-butyl(dimethyl)silyl]oxy-1-trimethylsilyltridec-1-yn-7-ol
CID 86668329
potassium 6-[tert-butyl(dimethyl)silyl]oxyhex-1-ynyl-trifluoroboranuide
CID 23696339
acetic acid;6-[tert-butyl(dimethyl)silyl]oxyhexan-1-ol
CID 71376160
(3R)-7-[tert-butyl(dimethyl)silyl]oxyheptane-1,3-diol
CID 15605935
lithium tert-butyl-hex-5-ynoxy-dimethylsilane
CID 11009447

Frequently Asked Questions

What is the IUPAC name of 9-[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxynon-4-yn-1-ol?
The IUPAC name of 9-[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxynon-4-yn-1-ol (CID 22164928) is 9-[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxynon-4-yn-1-ol.
What is the SMILES notation for 9-[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxynon-4-yn-1-ol?
The canonical SMILES for 9-[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxynon-4-yn-1-ol is CC(C)C(C)(C)[Si](C)(C)OCCCCC#CCCCO.
What is the InChIKey of 9-[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxynon-4-yn-1-ol?
The InChIKey is GVUQZJLMHLOPPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34O2Si/c1-16(2)17(3,4)20(5,6)19-15-13-11-9-7-8-10-12-14-18/h16,18H,9-15H2,1-6H3.
What are the key properties of 9-[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxynon-4-yn-1-ol?
9-[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxynon-4-yn-1-ol has a molecular weight of 298.54 g/mol, XLogP of 4.59, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxynon-4-yn-1-ol is sourced from PubChem (CID 22164928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).