Basic information
- CAS
24786-56-9- Standard SMILES
CCn1c(N)nc2cc(Br)ccc21- InChIKey
PKXDSPHJYREQRJ-UHFFFAOYSA-N- Molecular formula
- C9H10BrN3
- Average molar mass
- 240.1 g/mol
- Monoisotopic mass
- 239.00581
Names & identifiers
- Preferred name
- 5-bromo-1-ethyl-1H-1,3-benzodiazol-2-amine
- IUPAC
- 5-bromo-1-ethylbenzimidazol-2-amine
- English name
- 1H-Benzimidazol-2-amine, 5-bromo-1-ethyl-
- Molecular formula
- C9H10BrN3
- Molecular weight
- 240.1
Names & synonyms
5-bromo-1-ethyl-1H-1,3-benzodiazol-2-amine24786-56-9RefChem:532787875-431-85-bromo-1-ethylbenzimidazol-2-amineZAA786565-bromo-1-ethyl-benzimidazol-2-amineAKOS009853880DB-100176CS-0224853EN300-121389G57821
Show more names
5-Bromo-1-ethyl-1H-benzimidazol-2-amine1H-Benzimidazol-2-amine, 5-bromo-1-ethyl-
Database identifiers
- CAS
24786-56-9- PubChem CID
- 39733241
- EC Number
- 875-431-8
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 43.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 188
Physicochemical properties
- Boiling point
- 395.2 · 395.2±34.0 °C(Predicted)
- Density
- 1.66 · 1.66±0.1 g/cm3(Predicted)
- pka
- 6.22 · 6.22±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H302-H319-H315
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
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%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H335-H302-H319-H315
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Suppliers1 total
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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