N-(4-nitro-2,1,3-benzoxadiazol-7-yl)tellurohydroxylamine

C6H4N4O3Te — CID 174701841

IUPACN-(4-nitro-2,1,3-benzoxadiazol-7-yl)tellurohydroxylamine
SMILESO=[N+]([O-])c1ccc(N[TeH])c2nonc12
InChIInChI=1S/C6H4N4O3Te/c11-10(12)4-2-1-3(9-14)5-6(4)8-13-7-5/h1-2,9,14H
InChIKeyVHNDNSSHHWUBGM-UHFFFAOYSA-N
MW307.72 g/mol
LogP0.36
Rot. Bonds2

About N-(4-nitro-2,1,3-benzoxadiazol-7-yl)tellurohydroxylamine

N-(4-nitro-2,1,3-benzoxadiazol-7-yl)tellurohydroxylamine (PubChem CID 174701841) has the molecular formula C6H4N4O3Te and a molecular weight of 307.72 g/mol. Its IUPAC name is N-(4-nitro-2,1,3-benzoxadiazol-7-yl)tellurohydroxylamine.

Molecular Properties

Compound NameN-(4-nitro-2,1,3-benzoxadiazol-7-yl)tellurohydroxylamine
PubChem CID174701841
Molecular FormulaC6H4N4O3Te
Molecular Weight307.72 g/mol
Exact Mass309.93
IUPAC NameN-(4-nitro-2,1,3-benzoxadiazol-7-yl)tellurohydroxylamine
SMILESO=[N+]([O-])c1ccc(N[TeH])c2nonc12
InChIInChI=1S/C6H4N4O3Te/c11-10(12)4-2-1-3(9-14)5-6(4)8-13-7-5/h1-2,9,14H
InChIKeyVHNDNSSHHWUBGM-UHFFFAOYSA-N
XLogP0.36
TPSA94.09 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.72
LogP ≤ 50.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-ethyl-4-nitro-2,1,3-benzoxadiazol-7-amine
CID 13452090
(4-nitro-2,1,3-benzoxadiazol-7-yl)sulfamic acid
CID 23370852
4-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]phenol
CID 3128214
2-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]phenol
CID 3128188
4-nitro-N-(2,2,2-trifluoroethyl)-2,1,3-benzoxadiazol-7-amine
CID 43517302
N-(3,3-dimethylbutan-2-yl)-4-nitro-2,1,3-benzoxadiazol-7-amine
CID 115685855
1-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]propan-2-one
CID 89125533
2-chloro-N-(4-nitro-2,1,3-benzoxadiazol-7-yl)acetamide
CID 177471219
N-(1-methylcyclopentyl)-4-nitro-2,1,3-benzoxadiazol-7-amine
CID 61368890
N-(cyclobutylmethyl)-4-nitro-2,1,3-benzoxadiazol-7-amine
CID 43329354
N-(2-methoxyethyl)-4-nitro-2,1,3-benzoxadiazol-7-amine
CID 43395012
4-chloro-7-nitro-2,1,3-benzoxadiazole
CID 159389274

Frequently Asked Questions

What is the IUPAC name of N-(4-nitro-2,1,3-benzoxadiazol-7-yl)tellurohydroxylamine?
The IUPAC name of N-(4-nitro-2,1,3-benzoxadiazol-7-yl)tellurohydroxylamine (CID 174701841) is N-(4-nitro-2,1,3-benzoxadiazol-7-yl)tellurohydroxylamine.
What is the SMILES notation for N-(4-nitro-2,1,3-benzoxadiazol-7-yl)tellurohydroxylamine?
The canonical SMILES for N-(4-nitro-2,1,3-benzoxadiazol-7-yl)tellurohydroxylamine is O=[N+]([O-])c1ccc(N[TeH])c2nonc12.
What is the InChIKey of N-(4-nitro-2,1,3-benzoxadiazol-7-yl)tellurohydroxylamine?
The InChIKey is VHNDNSSHHWUBGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4N4O3Te/c11-10(12)4-2-1-3(9-14)5-6(4)8-13-7-5/h1-2,9,14H.
What are the key properties of N-(4-nitro-2,1,3-benzoxadiazol-7-yl)tellurohydroxylamine?
N-(4-nitro-2,1,3-benzoxadiazol-7-yl)tellurohydroxylamine has a molecular weight of 307.72 g/mol, XLogP of 0.36, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-nitro-2,1,3-benzoxadiazol-7-yl)tellurohydroxylamine is sourced from PubChem (CID 174701841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).