2-bromo-N-ethylbenzamide
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Basic information
- CAS
80031-02-3- Standard SMILES
CCNC(=O)c1ccccc1Br- InChIKey
DWCBZUWYUAIEEP-UHFFFAOYSA-N- Molecular formula
- C9H10BrNO
- Average molar mass
- 228.09 g/mol
- Monoisotopic mass
- 226.99458
Names & identifiers
- Preferred name
- 2-bromo-N-ethylbenzamide
- IUPAC
- 2-bromo-N-ethylbenzamide
- English name
- 2-BROMO-N-ETHYLBENZAMIDE
- Molecular formula
- C9H10BrNO
- Molecular weight
- 228.09
Names & synonyms
2-bromo-N-ethylbenzamide80031-02-3DTXSID00392593RefChem:257603DTXCID50343454N-ETHYL 2-BROMOBENZAMIDEMFCD012118942-Bromo-N-ethylbenzamide-d4SCHEMBL6427422SCHEMBL11576339SCHEMBL11576340STL260084
Show more names
CHEMBRDG-BB 5348641Benzamide, 2-bromo-N-ethyl-2-Bromo-N-ethylbenzamide98%2-Bromo-N-ethylbenzamide 98%2-bromo-N-ethylbenzamide(SALTDATA: FREE)
AKOS000191191SB77209AS-58263CS-003763810.14272/DWCBZUWYUAIEEP-UHFFFAOYSA-Ndoi:10.14272/DWCBZUWYUAIEEP-UHFFFAOYSA-NF094000Z30281214
Database identifiers
- CAS
80031-02-3- PubChem CID
- 3450992
- DTXSID
DTXSID00392593- Nikkaji
- J570.615G
Properties
Computed structural propertiesFilling in
- XLogP
- 1.4
- 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
- 161
Physicochemical properties
- Melting point
- 91 · 91-95
- Boiling point
- 330.5 · 330.5±25.0 °C(Predicted)
- Density
- 1.403 · 1.403±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 14.25 · 14.25±0.46(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
- Hazard Codes
- Xi
- Hazard Note
- Irritant
- HS Code
- 2924297099 · 2924297099
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2924297099
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_note
- Irritant
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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