4,5-Dibromo-1,2-dimethyl-1H-imidazole
Basic information
- CAS
16954-05-5- Standard SMILES
Cc1nc(Br)c(Br)n1C- InChIKey
IRPMMLNFWNJAMH-UHFFFAOYSA-N- Molecular formula
- C5H6Br2N2
- Average molar mass
- 253.92 g/mol
- Monoisotopic mass
- 251.88977
Names & identifiers
- Preferred name
- 4,5-Dibromo-1,2-dimethyl-1H-imidazole
- IUPAC
- 4,5-dibromo-1,2-dimethylimidazole
- English name
- 4,5-Dibromo-1,2-dimethyl-1H-imidazole
- Molecular formula
- C5H6Br2N2
- Molecular weight
- 253.92
Names & synonyms
4,5-Dibromo-1,2-dimethyl-1H-imidazoleDTXSID40307444RefChem:507613DTXCID70258571882-247-116954-05-54,5-dibromo-1,2-dimethylimidazoleMFCD02179518NSC191261SCHEMBL12359853AKOS015834956NSC-191261
Show more names
NSC 1912611H-Imidazole, 4,5-dibromo-1,2-dimethyl-
AB11301AS-63426SY041696CS-0152843EN300-719565F17283AMY119301,2-Dimethyl-4,5-dibromo-1H-imidazole
Database identifiers
- CAS
16954-05-5- PubChem CID
- 303178
- DTXSID
DTXSID40307444- EC Number
- 882-247-1
- Nikkaji
- J304.600A
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 17.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 109
Physicochemical properties
- Melting point
- 77 · 77-78°C
- Boiling point
- 331.3 · 331.3±22.0 °C(Predicted)
- Density
- 2.06 · 2.06±0.1 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- pka
- 3.13 · 3.13±0.60(Predicted)
- Appearance
- Off-white to light brown Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36/37/39
- HS Code
- 2933299090 · 2933299090
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
- hs_code
- 2933299090
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 26-36/37/39
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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