Basic information
- CAS
235426-31-0- Standard SMILES
Cc1cnc(Br)n1C- InChIKey
CQONRJOUCSSFLX-UHFFFAOYSA-N- Molecular formula
- C5H7BrN2
- Average molar mass
- 175.03 g/mol
- Monoisotopic mass
- 173.97926
Names & identifiers
- Preferred name
- 2-Bromo-1,5-dimethyl-1H-imidazole
- IUPAC
- 2-bromo-1,5-dimethylimidazole
- English name
- 2-Bromo-1,5-dimethyl-1H-imidazole
- Molecular formula
- C5H7BrN2
- Molecular weight
- 175.03
Names & synonyms
2-Bromo-1,5-dimethyl-1H-imidazole235426-31-0DTXSID70428398RefChem:256755DTXCID90379232691-788-02-bromo-1,5-dimethylimidazoleMFCD066599021H-Imidazole, 2-bromo-1,5-dimethyl-SCHEMBL3325158CQONRJOUCSSFLX-UHFFFAOYSA-NAKOS006343257
Show more names
1H-IMidazole,2-broMo-1,5-diMethyl2-Bromo-1,5-dimethyl-1H-imidazole 97%
AB26586AT22512PS-3654SY031085CS-0213130
Database identifiers
- CAS
235426-31-0- PubChem CID
- 7204876
- DTXSID
DTXSID70428398- EC Number
- 691-788-0
- Nikkaji
- J1.101.975G
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 17.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 86.5
Physicochemical properties
- Melting point
- 40 · 40-42
- Boiling point
- 253.6 · 253.6±33.0 °C(Predicted)
- Density
- 1.58 · 1.58±0.1 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- form
- solid
- pka
- 4.17 · 4.17±0.25(Predicted)
- color
- White
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H319
- Precautionary statements
- 305 · P305+P351+P338
- Hazard Codes
- Xn
- Risk Statements
- 22 · 22
- Hazard Note
- Harmful
- 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
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- hs_code
- 2933299090
- risk_code
- 22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- hazard_note
- Harmful
- Hazard statements
- H302-H319
- Precautionary statements
- P305+P351+P338
Chemistry & industry
Suppliers13 total
Aladdin Scientific[email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
上海源鼎化学科技有限公司21-57721279 18121011378 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]
赛纳斯特化学（欢迎点击联系）021-60343070
上海卓因生物科技有限公司021-61317773 · [email protected]
武汉凯威斯科技有限公司027-67849912 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 19370895928 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
武汉凯威斯科技有限公司027-67849912 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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