9-azidononoxy-tert-butyl-diphenylsilane

C25H37N3OSi — CID 155804238

IUPAC9-azidononoxy-tert-butyl-diphenylsilane
SMILESCC(C)(C)[Si](OCCCCCCCCCN=[N+]=[N-])(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H37N3OSi/c1-25(2,3)30(23-17-11-9-12-18-23,24-19-13-10-14-20-24)29-22-16-8-6-4-5-7-15-21-27-28-26/h9-14,17-20H,4-8,15-16,21-22H2,1-3H3
InChIKeyVKOYDEVKHDYIBD-UHFFFAOYSA-N
MW423.68 g/mol
LogP6.60
Rot. Bonds13

About 9-azidononoxy-tert-butyl-diphenylsilane

9-azidononoxy-tert-butyl-diphenylsilane (PubChem CID 155804238) has the molecular formula C25H37N3OSi and a molecular weight of 423.68 g/mol. Its IUPAC name is 9-azidononoxy-tert-butyl-diphenylsilane.

Molecular Properties

Compound Name9-azidononoxy-tert-butyl-diphenylsilane
PubChem CID155804238
Molecular FormulaC25H37N3OSi
Molecular Weight423.68 g/mol
Exact Mass423.27
IUPAC Name9-azidononoxy-tert-butyl-diphenylsilane
SMILESCC(C)(C)[Si](OCCCCCCCCCN=[N+]=[N-])(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H37N3OSi/c1-25(2,3)30(23-17-11-9-12-18-23,24-19-13-10-14-20-24)29-22-16-8-6-4-5-7-15-21-27-28-26/h9-14,17-20H,4-8,15-16,21-22H2,1-3H3
InChIKeyVKOYDEVKHDYIBD-UHFFFAOYSA-N
XLogP6.60
TPSA57.99 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500423.68
LogP ≤ 56.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

11-azidoundecoxy-tert-butyl-diphenylsilane
CID 138986552
12-[tert-butyl(diphenyl)silyl]oxydodecan-1-ol
CID 11015684
tert-butyl-(10-iododecoxy)-diphenylsilane
CID 10994946
tert-butyl-(5-iodopentoxy)-diphenylsilane
CID 10003991
8-bromooctoxy-tert-butyl-diphenylsilane
CID 22444390
7-[tert-butyl(diphenyl)silyl]oxy-2-methylheptan-2-ol
CID 102173958
tert-butyl-diphenyl-(8-trityloxyoctoxy)silane
CID 102242281
tert-butyl-diphenyl-undec-10-enoxysilane
CID 25058521
3-bromopropoxy-tert-butyl-diphenylsilane
CID 11245865
3-[tert-butyl(diphenyl)silyl]oxypropan-1-ol;propane-1,3-diol
CID 161331009
[(1R,2R)-2-(azidomethyl)cyclopropyl]methoxy-tert-butyl-diphenylsilane
CID 10021768
2-[4-[tert-butyl(diphenyl)silyl]oxybutoxy]ethanol
CID 156707018

Frequently Asked Questions

What is the IUPAC name of 9-azidononoxy-tert-butyl-diphenylsilane?
The IUPAC name of 9-azidononoxy-tert-butyl-diphenylsilane (CID 155804238) is 9-azidononoxy-tert-butyl-diphenylsilane.
What is the SMILES notation for 9-azidononoxy-tert-butyl-diphenylsilane?
The canonical SMILES for 9-azidononoxy-tert-butyl-diphenylsilane is CC(C)(C)[Si](OCCCCCCCCCN=[N+]=[N-])(c1ccccc1)c1ccccc1.
What is the InChIKey of 9-azidononoxy-tert-butyl-diphenylsilane?
The InChIKey is VKOYDEVKHDYIBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H37N3OSi/c1-25(2,3)30(23-17-11-9-12-18-23,24-19-13-10-14-20-24)29-22-16-8-6-4-5-7-15-21-27-28-26/h9-14,17-20H,4-8,15-16,21-22H2,1-3H3.
What are the key properties of 9-azidononoxy-tert-butyl-diphenylsilane?
9-azidononoxy-tert-butyl-diphenylsilane has a molecular weight of 423.68 g/mol, XLogP of 6.60, 13 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-azidononoxy-tert-butyl-diphenylsilane is sourced from PubChem (CID 155804238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).