Basic information
- CAS
139502-25-3- Standard SMILES
Brc1c(NC2=NCCN2)ccc2cn[nH]c12- InChIKey
SGCRPVAWFGYQAS-UHFFFAOYSA-N- Molecular formula
- C10H10BrN5
- Average molar mass
- 280.12 g/mol
- Monoisotopic mass
- 279.01196
Overview
structure given in first source
Names & identifiers
- Preferred name
- 7-Bromo-N-(2-imidazolidinylidene)-1H-indazol-6-amine
- IUPAC
- 7-bromo-N-(4,5-dihydro-1H-imidazol-2-yl)-1H-indazol-6-amine
- English name
- 7-bromo-N-(2-imidazolidinylidene)-1H-indazol-6-amine
- Molecular formula
- C10H10BrN5
- Molecular weight
- 280.12
Names & synonyms
7-Biia139502-25-37-Bromo-N-(2-imidazolidinylidene)-1H-indazol-6-amineDTXSID50161079RefChem:105887DTXCID70835707-bromo-N-(4,5-dihydro-1H-imidazol-2-yl)-1H-indazol-6-amineSCHEMBL83026771H-Indazol-6-amine, 7-bromo-N-(2-imidazolidinylidene)-1H-Indazol-6-amine, 7-bromo-N-(4,5-dihydro-1H-imidazol-2-yl)-
Database identifiers
- CAS
139502-25-3- PubChem CID
- 132245
- DTXSID
DTXSID50161079- Nikkaji
- J458.790A
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 65.1 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 295
Physicochemical properties
- Boiling point
- 459.9 · 459.9±55.0 °C(Predicted)
- Density
- 1.94 · 1.94±0.1 g/cm3(Predicted)
- pka
- 12.53 · 12.53±0.40(Predicted)
Chemistry & industry
Suppliers1 total
CHEMICAL LAND21[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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