Basic information
- Standard SMILES
Cc1cc([N+](=O)[O-])ncc1Br- InChIKey
OZAONQSRAXEGMW-UHFFFAOYSA-N- Molecular formula
- C6H5BrN2O2
- Average molar mass
- 217.02 g/mol
Names & identifiers
- Preferred name
- 5-Bromo-4-methyl-2-nitropyridine
- IUPAC
- 5-bromo-4-methyl-2-nitropyridine
Names & synonyms
5-Bromo-4-Methyl-2-Nitropyridine1225278-70-5RefChem:533750839-848-95-bromo-4-methyl-2-nitro-pyridineMFCD17014995SCHEMBL2414862OZAONQSRAXEGMW-UHFFFAOYSA-NAZB27870AKOS015842404GS-5035DA-37737
Show more names
SY156227CS-0442689D84499EN300-136734F767201
Database identifiers
- CAS
1225278-70-5- PubChem CID
- 53350372
- EC Number
- 839-848-9
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 58.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 159
Safety & regulation
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
3 records
Linked notes
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