10-azidodec-5-enoxy-tert-butyl-diphenylsilane

C26H37N3OSi — CID 123780813

IUPAC10-azidodec-5-enoxy-tert-butyl-diphenylsilane
SMILESCC(C)(C)[Si](OCCCCC=CCCCCN=[N+]=[N-])(c1ccccc1)c1ccccc1
InChIInChI=1S/C26H37N3OSi/c1-26(2,3)31(24-18-12-10-13-19-24,25-20-14-11-15-21-25)30-23-17-9-7-5-4-6-8-16-22-28-29-27/h4-5,10-15,18-21H,6-9,16-17,22-23H2,1-3H3
InChIKeyMBRIVCKOAAZXJE-UHFFFAOYSA-N
MW435.69 g/mol
LogP6.77
Rot. Bonds13

About 10-azidodec-5-enoxy-tert-butyl-diphenylsilane

10-azidodec-5-enoxy-tert-butyl-diphenylsilane (PubChem CID 123780813) has the molecular formula C26H37N3OSi and a molecular weight of 435.69 g/mol. Its IUPAC name is 10-azidodec-5-enoxy-tert-butyl-diphenylsilane.

Molecular Properties

Compound Name10-azidodec-5-enoxy-tert-butyl-diphenylsilane
PubChem CID123780813
Molecular FormulaC26H37N3OSi
Molecular Weight435.69 g/mol
Exact Mass435.27
IUPAC Name10-azidodec-5-enoxy-tert-butyl-diphenylsilane
SMILESCC(C)(C)[Si](OCCCCC=CCCCCN=[N+]=[N-])(c1ccccc1)c1ccccc1
InChIInChI=1S/C26H37N3OSi/c1-26(2,3)31(24-18-12-10-13-19-24,25-20-14-11-15-21-25)30-23-17-9-7-5-4-6-8-16-22-28-29-27/h4-5,10-15,18-21H,6-9,16-17,22-23H2,1-3H3
InChIKeyMBRIVCKOAAZXJE-UHFFFAOYSA-N
XLogP6.77
TPSA57.99 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500435.69
LogP ≤ 56.77
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

tert-Butyl(hexyloxy)diphenylsilane
CID 11338517
4-[[(1,1-Dimethylethyl)diphenylsilyl]oxy]-1-butanamine
CID 10042117
Tert-butyl-pentoxy-diphenylsilane
CID 10925447
6-Amino-1-(t-butyldiphenylsilyloxy)hexane
CID 13009541
[3-(Azidomethyl)-2,2-difluorocyclopropyl]methoxy-tert-butyl-diphenylsilane
CID 21044037
[(1R,3R)-3-(azidomethyl)-2,2-difluorocyclopropyl]methoxy-tert-butyl-diphenylsilane
CID 58682743
[(1R,3S,4S)-4-azido-3-fluorocyclohexyl]oxy-tert-butyl-diphenylsilane
CID 123446689
[(1R,3R,4S)-4-azido-3-fluorocyclohexyl]oxy-tert-butyl-diphenylsilane
CID 124022681
(4-Azido-3-fluorocyclohexyl)oxy-tert-butyl-diphenylsilane
CID 173573617
Tert-butyl-hept-6-enoxy-diphenylsilane
CID 10784231
tert-butyl-[(E)-dec-5-enoxy]-diphenylsilane
CID 11188599
3-Azidobutoxy-tert-butyl-diphenylsilane
CID 11210404

Frequently Asked Questions

What is the IUPAC name of 10-azidodec-5-enoxy-tert-butyl-diphenylsilane?
The IUPAC name of 10-azidodec-5-enoxy-tert-butyl-diphenylsilane (CID 123780813) is 10-azidodec-5-enoxy-tert-butyl-diphenylsilane.
What is the SMILES notation for 10-azidodec-5-enoxy-tert-butyl-diphenylsilane?
The canonical SMILES for 10-azidodec-5-enoxy-tert-butyl-diphenylsilane is CC(C)(C)[Si](OCCCCC=CCCCCN=[N+]=[N-])(c1ccccc1)c1ccccc1.
What is the InChIKey of 10-azidodec-5-enoxy-tert-butyl-diphenylsilane?
The InChIKey is MBRIVCKOAAZXJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H37N3OSi/c1-26(2,3)31(24-18-12-10-13-19-24,25-20-14-11-15-21-25)30-23-17-9-7-5-4-6-8-16-22-28-29-27/h4-5,10-15,18-21H,6-9,16-17,22-23H2,1-3H3.
What are the key properties of 10-azidodec-5-enoxy-tert-butyl-diphenylsilane?
10-azidodec-5-enoxy-tert-butyl-diphenylsilane has a molecular weight of 435.69 g/mol, XLogP of 6.77, 13 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-azidodec-5-enoxy-tert-butyl-diphenylsilane is sourced from PubChem (CID 123780813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).