Basic information
- CAS
5439-13-4- Standard SMILES
O=C(CBr)Nc1ccc(Br)cc1- InChIKey
FDPCSKPUJUALLE-UHFFFAOYSA-N- Molecular formula
- C8H7Br2NO
- Average molar mass
- 292.95 g/mol
- Monoisotopic mass
- 290.88944
Names & identifiers
- Preferred name
- 2-Bromo-n-(4-bromophenyl)acetamide
- IUPAC
- 2-bromo-N-(4-bromophenyl)acetamide
- English name
- 2-Bromo-N-(4-bromophenyl)acetamide
- Molecular formula
- C8H7Br2NO
- Molecular weight
- 292.96
Names & synonyms
2-bromo-n-(4-bromophenyl)acetamide5439-13-4MFCD001244012,4'-DibromoacetanilideAcetamide, 2-bromo-N-(4-bromophenyl)-Acetamide, N-(4-bromophenyl)-2-bromo-NSC15062SCHEMBL1039601DTXSID80969500ALBB-010614NSC-150622-Bromo-N-(4-bromophenyl)-acetamide
Show more names
2-bromo-N-(4-bromophenyl)ethanamide
AKOS005172493LS-03610H25760F368213
Database identifiers
- CAS
5439-13-4- PubChem CID
- 225526
- DTXSID
DTXSID80969500- EC Number
- 109-852-9
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 155
Experimental & physicochemical properties
Kovats Retention Index1826
Physicochemical properties
- HazardClass
- IRRITANT
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, 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 CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (100%)
Safety data
- hazard_class
- IRRITANT
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers17 total
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]
山东利腾生物科技有限公司+86-18663721413 +86-15552573001 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
烟台正信新材料科技有限公司13854547682 13854547682 · [email protected]
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
南兴化工（江苏）有限公司0512-66387035 18662433356 · [email protected]
郑州康弗辰医药科技有限公司18210788515; 18210788515 · [email protected]
武汉峰耀同辉化学制品有限公司027-87466205 15377579727 · [email protected]
合肥钼凯医药科技有限公司18130062233 · [email protected]
Related reactions
4 records
Compound notes
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