(Z)-1-[azido(ditert-butyl)silyl]-2-ethoxy-2-hydroxyethenediazonium

C12H24N5O2Si+ — CID 10968505

IUPAC(Z)-1-[azido(ditert-butyl)silyl]-2-ethoxy-2-hydroxyethenediazonium
SMILESCCO/C(O)=C(/[N+]#N)[Si](N=[N+]=[N-])(C(C)(C)C)C(C)(C)C
InChIInChI=1S/C12H23N5O2Si/c1-8-19-10(18)9(15-13)20(17-16-14,11(2,3)4)12(5,6)7/h8H2,1-7H3/p+1/b10-9-
InChIKeyNRDXRBVPRCBZSD-KTKRTIGZSA-O
MW298.44 g/mol
LogP5.00
Rot. Bonds4

About (Z)-1-[azido(ditert-butyl)silyl]-2-ethoxy-2-hydroxyethenediazonium

(Z)-1-[azido(ditert-butyl)silyl]-2-ethoxy-2-hydroxyethenediazonium (PubChem CID 10968505) has the molecular formula C12H24N5O2Si+ and a molecular weight of 298.44 g/mol. Its IUPAC name is (Z)-1-[azido(ditert-butyl)silyl]-2-ethoxy-2-hydroxyethenediazonium.

Molecular Properties

Compound Name(Z)-1-[azido(ditert-butyl)silyl]-2-ethoxy-2-hydroxyethenediazonium
PubChem CID10968505
Molecular FormulaC12H24N5O2Si+
Molecular Weight298.44 g/mol
Exact Mass298.17
IUPAC Name(Z)-1-[azido(ditert-butyl)silyl]-2-ethoxy-2-hydroxyethenediazonium
SMILESCCO/C(O)=C(/[N+]#N)[Si](N=[N+]=[N-])(C(C)(C)C)C(C)(C)C
InChIInChI=1S/C12H23N5O2Si/c1-8-19-10(18)9(15-13)20(17-16-14,11(2,3)4)12(5,6)7/h8H2,1-7H3/p+1/b10-9-
InChIKeyNRDXRBVPRCBZSD-KTKRTIGZSA-O
XLogP5.00
TPSA106.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.44
LogP ≤ 55.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'Azo_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Related Compounds

ethyl 2-[azido(ditert-butyl)silyl]-2-diazoacetate
CID 85349741
(1E,3Z)-1-ethoxy-1-hydroxyhexa-1,3-diene-2-diazonium
CID 10797180
(1E,3E,5E)-1-ethoxy-1-hydroxyhepta-1,3,5-triene-2-diazonium
CID 10903274
azidomethane;ethyl 2,2-dimethylpropanoate;phosphane
CID 161474918
ethyl 2-diazo-2-[ditert-butyl(isothiocyanato)silyl]acetate
CID 137288034
ethyl 3-azido-2-hydroxy-2-methylpropanoate
CID 86095918
ethyl 4-azido-2,2-dimethylbutanoate
CID 150968965
ethyl (2S)-2-azidopropanoate
CID 15266179
ethyl 2-[3-(azidomethyl)pyrazol-1-yl]-2-methylpropanoate
CID 164570531
ethyl 2-(2-azidoethylamino)-2-(1,3-thiazol-2-yl)propanoate
CID 66188847
diethyl 2-azido-2-phenylpropanedioate
CID 14066098
tert-butyl 4-azido-2-methylbutanoate
CID 150269304

Frequently Asked Questions

What is the IUPAC name of (Z)-1-[azido(ditert-butyl)silyl]-2-ethoxy-2-hydroxyethenediazonium?
The IUPAC name of (Z)-1-[azido(ditert-butyl)silyl]-2-ethoxy-2-hydroxyethenediazonium (CID 10968505) is (Z)-1-[azido(ditert-butyl)silyl]-2-ethoxy-2-hydroxyethenediazonium.
What is the SMILES notation for (Z)-1-[azido(ditert-butyl)silyl]-2-ethoxy-2-hydroxyethenediazonium?
The canonical SMILES for (Z)-1-[azido(ditert-butyl)silyl]-2-ethoxy-2-hydroxyethenediazonium is CCO/C(O)=C(/[N+]#N)[Si](N=[N+]=[N-])(C(C)(C)C)C(C)(C)C.
What is the InChIKey of (Z)-1-[azido(ditert-butyl)silyl]-2-ethoxy-2-hydroxyethenediazonium?
The InChIKey is NRDXRBVPRCBZSD-KTKRTIGZSA-O. The full InChI is InChI=1S/C12H23N5O2Si/c1-8-19-10(18)9(15-13)20(17-16-14,11(2,3)4)12(5,6)7/h8H2,1-7H3/p+1/b10-9-.
What are the key properties of (Z)-1-[azido(ditert-butyl)silyl]-2-ethoxy-2-hydroxyethenediazonium?
(Z)-1-[azido(ditert-butyl)silyl]-2-ethoxy-2-hydroxyethenediazonium has a molecular weight of 298.44 g/mol, XLogP of 5.00, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-[azido(ditert-butyl)silyl]-2-ethoxy-2-hydroxyethenediazonium is sourced from PubChem (CID 10968505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).