3-BROMO-4-HYDROXYBENZONITRILE
- Product Name
- 3-BROMO-4-HYDROXYBENZONITRILE
- CAS No.
- 2315-86-8
- Chemical Name
- 3-BROMO-4-HYDROXYBENZONITRILE
- Synonyms
- TIMTEC-BB SBB005818;2-BROMO-4-CYANOPHENOL;LABOTEST-BB LT01143437;Bromo-4-hydroxybenzonitrile;3-broMo-4-hydroxybenzonirile;3-Brom-4-hydroxy-benzonitril;3-BROMO-4-HYDROXYBENZONITRILE;Benzonitrile, 3-broMo-4-hydroxy-;3-Bromo-4-hydroxybenzonitrile 97%;3-Bromo-4-hydroxybenzonitrile,99%
- CBNumber
- CB5108631
- Molecular Formula
- C7H4BrNO
- Formula Weight
- 198.02
- MOL File
- 2315-86-8.mol
3-BROMO-4-HYDROXYBENZONITRILE Property
- Melting point:
- 155-159 °C(lit.)
- Boiling point:
- 271.1±25.0 °C(Predicted)
- Density
- 1.79±0.1 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- solubility
- Chloroform (Slightly), Methanol (Slightly, Heated)
- pka
- 6.30±0.18(Predicted)
- form
- Solid
- color
- Off-White to Pale Beige
- BRN
- 2207020
- InChI
- InChI=1S/C7H4BrNO/c8-6-3-5(4-9)1-2-7(6)10/h1-3,10H
- InChIKey
- HLHNOIAOWQFNGW-UHFFFAOYSA-N
- SMILES
- C(#N)C1=CC=C(O)C(Br)=C1
- CAS DataBase Reference
- 2315-86-8(CAS DataBase Reference)
Hazard and Precautionary Statements (GHS)
- Symbol(GHS)
-
- Signal word
- Warning
- Hazard statements
-
H302Harmful if swallowed
H315Causes skin irritation
H319Causes serious eye irritation
H335May cause respiratory irritation
- Precautionary statements
-
P261Avoid breathing dust/fume/gas/mist/vapours/spray.
P264Wash hands thoroughly after handling.
P264Wash skin thouroughly after handling.
P270Do not eat, drink or smoke when using this product.
P280Wear protective gloves/protective clothing/eye protection/face protection.
P304+P340IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing.
P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
P405Store locked up.
P501Dispose of contents/container to..…
N-Bromosuccinimide Price
- Product number
- 652563
- Product name
- 3-Bromo-4-hydroxybenzonitrile
- Purity
- 97%
- Packaging
- 25g
- Price
- $144
- Updated
- 2023/06/20
- Product number
- B2037
- Product name
- 3-Bromo-4-hydroxybenzonitrile
- Purity
- >95.0%(GC)
- Packaging
- 5g
- Price
- $68
- Updated
- 2025/07/31
- Product number
- B2037
- Product name
- 3-Bromo-4-hydroxybenzonitrile
- Purity
- >95.0%(GC)
- Packaging
- 25g
- Price
- $205
- Updated
- 2025/07/31
- Product number
- B682570
- Product name
- 3-Bromo-4-hydroxybenzonitrile
- Packaging
- 10g
- Price
- $55
- Updated
- 2021/12/16
- Product number
- FB70528
- Product name
- 3-Bromo-4-hydroxybenzonitrile
- Packaging
- 50g
- Price
- $55
- Updated
- 2021/12/16
3-BROMO-4-HYDROXYBENZONITRILE Chemical Properties,Usage,Production
Chemical Properties
brown crystals or needles
Uses
3-Bromo-4-hydroxybenzonitrile is a reactant that has been used in the preparation of tetrazoles.
Synthesis
767-00-0
2315-86-8
4-Hydroxybenzonitrile (III) (5.0 g, 0.042 mol) was dissolved in acetonitrile (50 mL) under nitrogen atmosphere. The reaction mixture was cooled to -15 °C and trifluoromethanesulfonic acid (CF3SO3H) (3.7 mL, 6.3 g, 0.042 mol) was slowly added. Maintaining the reaction temperature at -15 °C, N-bromosuccinimide (NBS) (8.2 g, 0.046 mol) was added in 6 additions in batches. After addition, the reaction mixture was returned to room temperature and continued to be stirred under nitrogen atmosphere for 4 h. The reaction process was monitored by thin-layer chromatography (TLC) (unfolding reagent: hexane/ethyl acetate = 75:25, detection method: UV and KMnO4 color development). When the raw materials were completely consumed, the reaction mixture was diluted with aqueous sodium carbonate (Na2CO3) and extracted with methyl tert-butyl ether (MTBE) (3 x 50 mL). The organic layers were combined, dried with anhydrous sodium sulfate, and concentrated under reduced pressure to remove the solvent to give 3-bromo-4-hydroxybenzonitrile (IV) as a white solid (7.7 g, 93% yield).1H NMR (DMSO-d6, 300 MHz, 300 K): δ=8.04 (d, J=2.2Hz, 1H), 7.63 (dd, J=2.2Hz, 8.5Hz, 8.5 Hz. 1H), 7.04 (d, J=8.5Hz, 1H).
References
[1] Patent: US9181298, 2015, B2. Location in patent: Page/Page column 33; Sheet 8
[2] Journal of Organic Chemistry, 2005, vol. 70, # 11, p. 4267 - 4271
[3] Patent: WO2010/142653, 2010, A1. Location in patent: Page/Page column 14
[4] Patent: CN103333134, 2016, B. Location in patent: Paragraph 0101; 0102
[5] RSC Advances, 2014, vol. 4, # 49, p. 25898 - 25903
3-BROMO-4-HYDROXYBENZONITRILE Preparation Products And Raw materials
Raw materials
Preparation Products
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View Lastest Price from 3-BROMO-4-HYDROXYBENZONITRILE manufacturers
- Product
- 3-BROMO-4-HYDROXYBENZONITRILE 2315-86-8
- Price
- US $1.10/g
- Min. Order
- 1g
- Purity
- 99.0% min
- Supply Ability
- 100 tons min
- Release date
- 2025-05-26
- Product
- 3-BROMO-4-HYDROXYBENZONITRILE 2315-86-8
- Price
- US $0.00-0.00/KG
- Min. Order
- 1KG
- Purity
- 99%
- Supply Ability
- 2000
- Release date
- 2025-04-29
- Product
- 3-Bromo-4-hydroxybenzonitrile 2315-86-8
- Price
- US $0.10/KG
- Min. Order
- 1KG
- Purity
- 99.0%
- Supply Ability
- 1000 tons
- Release date
- 2020-01-06