bromo(tritiosulfanyl)azanide

HBrNS- — CID 58711055

IUPACbromo(tritiosulfanyl)azanide
SMILES[3H]S[N-]Br
InChIInChI=1S/BrHNS/c1-2-3/h3H/q-1/i/hT
InChIKeyAWZPJJFIXCROBF-MNYXATJNSA-N
MW128.99 g/mol
LogP1.51
Rot. Bonds1

About bromo(tritiosulfanyl)azanide

bromo(tritiosulfanyl)azanide (PubChem CID 58711055) has the molecular formula HBrNS- and a molecular weight of 128.99 g/mol. Its IUPAC name is bromo(tritiosulfanyl)azanide.

Molecular Properties

Compound Namebromo(tritiosulfanyl)azanide
PubChem CID58711055
Molecular FormulaHBrNS-
Molecular Weight128.99 g/mol
Exact Mass127.91
IUPAC Namebromo(tritiosulfanyl)azanide
SMILES[3H]S[N-]Br
InChIInChI=1S/BrHNS/c1-2-3/h3H/q-1/i/hT
InChIKeyAWZPJJFIXCROBF-MNYXATJNSA-N
XLogP1.51
TPSA14.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms3
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.99
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of bromo(tritiosulfanyl)azanide?
The IUPAC name of bromo(tritiosulfanyl)azanide (CID 58711055) is bromo(tritiosulfanyl)azanide.
What is the SMILES notation for bromo(tritiosulfanyl)azanide?
The canonical SMILES for bromo(tritiosulfanyl)azanide is [3H]S[N-]Br.
What is the InChIKey of bromo(tritiosulfanyl)azanide?
The InChIKey is AWZPJJFIXCROBF-MNYXATJNSA-N. The full InChI is InChI=1S/BrHNS/c1-2-3/h3H/q-1/i/hT.
What are the key properties of bromo(tritiosulfanyl)azanide?
bromo(tritiosulfanyl)azanide has a molecular weight of 128.99 g/mol, XLogP of 1.51, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for bromo(tritiosulfanyl)azanide is sourced from PubChem (CID 58711055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).