5-Bromosalicylamide
Basic information
- CAS
6329-74-4- Standard SMILES
NC(=O)c1cc(Br)ccc1O- InChIKey
MRMOPHYFXXZTFN-UHFFFAOYSA-N- Molecular formula
- C7H6BrNO2
- Average molar mass
- 216.03 g/mol
- Monoisotopic mass
- 214.95819053
Names & identifiers
- Preferred name
- 5-Bromosalicylamide
- IUPAC
- 5-bromo-2-hydroxybenzamide
- English name
- 5-Bromosalicylamide
- Molecular formula
- C7H6BrNO2
- Molecular weight
- 216.03
Names & synonyms
5-bromo-2-hydroxybenzamide5-Bromosalicylamide6329-74-4Salicylamide, bromo-Salicylamide, 5-bromo-Benzamide, 5-bromo-2-hydroxy-XQU5NZU8HREINECS 228-704-5NSC 14278BRN 3530373NSC-14278DTXSID40212685
Show more names
bromo-salicylamidbromo-2-hydroxybenzamide5-broMo-2-hydeoxybenzaMide
2-HYDROXY-5-BROMOBENZAMIDE1-10-00-00048 (Beilstein Handbook Reference)RefChem:534123Salicylamide, 5-bromo-(8CI)DTXCID70135176Benzamide, 5-bromo-2-hydroxy-(9CI)228-704-5Bromosalicylamide
Database identifiers
- CAS
6329-74-4- PubChem CID
- 72876
- DTXSID
DTXSID40212685- UNII
- XQU5NZU8HR
- EC Number
- 228-704-5
- Nikkaji
- J48.316H
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 63.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 163
Physicochemical properties
- Melting point
- 241 · 241-245 °C(lit.)
- Boiling point
- 316.6 · 316.6±32.0 °C(Predicted)
- Density
- 1.759 · 1.759±0.06 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- pka
- 7.79 · 7.79±0.18(Predicted)
- Appearance
- White to off-white Solid
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 5 NZU8HR · XQU5NZU8HR
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H317
- Precautionary statements
- 280 · P280
- Hazard Codes
- Xn
- Risk Statements
- 22 · 22-43
- Safety Statements
- 28 · 28-36/37
- WGK Germany
- 3 · 3
- RTECS
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, P270, P272, P280, P301+P317, P302+P352, P321, P330, P333+P317, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 1 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
- wgk
- 3
- rtecs
- VN7000000
- risk_code
- 22-43
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- safety_code
- 28-36/37
- Hazard statements
- H302-H317
- Precautionary statements
- P280
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers
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Related reactions
10 records
Compound notes
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