Basic information
- CAS
24786-55-8- Standard SMILES
Cn1c(N)nc2cc(Br)ccc21- InChIKey
AAXWQLLNLMEEQX-UHFFFAOYSA-N- Molecular formula
- C8H8BrN3
- Average molar mass
- 226.07 g/mol
- Monoisotopic mass
- 224.99016
Names & identifiers
- Preferred name
- 5-bromo-1-methyl-1H-1,3-benzodiazol-2-amine
- IUPAC
- 5-bromo-1-methylbenzimidazol-2-amine
Names & synonyms
5-bromo-1-methyl-1H-1,3-benzodiazol-2-amine24786-55-8RefChem:532810850-945-55-bromo-1-methylbenzimidazol-2-amine5-Bromo-1-methyl-1H-benzimidazol-2-amineSCHEMBL16755302SCHEMBL25579648ZAA78655AKOS0098540625-bromo-1-methyl-benzimidazol-2-amine5-bromo-1-methyl-1H-benzo[d]imidazol-2-amine
Show more names
EN300-645778F515368F8882-2766Z445183876
Database identifiers
- CAS
24786-55-8- PubChem CID
- 39733238
- EC Number
- 850-945-5
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 43.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 176
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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