2-(6-bromopyridin-2-yl)acetic acid
- Product Name
- 2-(6-bromopyridin-2-yl)acetic acid
- CAS No.
- 1093879-46-9
- Chemical Name
- 2-(6-bromopyridin-2-yl)acetic acid
- Synonyms
- 6-BroMo-2-pyridineacetic acid;2-Pyridineacetic acid, 6-bromo-;2-(6-bromo-2-pyridyl)acetic acid;2-(6-bromopyridin-2-yl)acetic acid
- CBNumber
- CB51557216
- Molecular Formula
- C7H6BrNO2
- Formula Weight
- 216.03
- MOL File
- 1093879-46-9.mol
2-(6-bromopyridin-2-yl)acetic acid Property
- Boiling point:
- 347.2±27.0 °C(Predicted)
- Density
- 1.710±0.06 g/cm3(Predicted)
- storage temp.
- under inert gas (nitrogen or Argon) at 2-8°C
- pka
- 3.76±0.10(Predicted)
- Appearance
- Off-white to light brown Solid
- InChI
- InChI=1S/C7H6BrNO2/c8-6-3-1-2-5(9-6)4-7(10)11/h1-3H,4H2,(H,10,11)
- InChIKey
- XZQWPHKCEJPCDK-UHFFFAOYSA-N
- SMILES
- C1(CC(O)=O)=NC(Br)=CC=C1
Safety
- HazardClass
- IRRITANT
- HS Code
- 2933399990
Hazard and Precautionary Statements (GHS)
- Symbol(GHS)
-
- Signal word
- Warning
- Hazard statements
-
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.
P271Use only outdoors or in a well-ventilated area.
P280Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352IF ON SKIN: wash with plenty of soap and water.
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.
P312Call a POISON CENTER or doctor/physician if you feel unwell.
P321Specific treatment (see … on this label).
P332+P313IF SKIN irritation occurs: Get medical advice/attention.
P337+P313IF eye irritation persists: Get medical advice/attention.
P362Take off contaminated clothing and wash before reuse.
P403+P233Store in a well-ventilated place. Keep container tightly closed.
P405Store locked up.
P501Dispose of contents/container to..…
N-Bromosuccinimide Price
- Product number
- OR52749
- Product name
- 2-(6-Bromopyridin-2-yl)acetic acid
- Packaging
- 250mg
- Price
- $133
- Updated
- 2021/12/16
- Product number
- OR52749
- Product name
- 2-(6-Bromopyridin-2-yl)acetic acid
- Packaging
- 1g
- Price
- $422
- Updated
- 2021/12/16
- Product number
- HCH0065460
- Product name
- 2-(6-BROMOPYRIDIN-2-YL)ACETIC ACID
- Purity
- 95.00%
- Packaging
- 1G
- Price
- $1206.98
- Updated
- 2021/12/16
- Product number
- OR52749
- Product name
- 2-(6-Bromopyridin-2-yl)acetic acid
- Packaging
- 5g
- Price
- $1340
- Updated
- 2021/12/16
- Product number
- SC-13240
- Product name
- 2-(6-bromopyridin-2-yl)aceticacid
- Purity
- 95
- Packaging
- 5g
- Price
- $583
- Updated
- 2021/12/16
2-(6-bromopyridin-2-yl)acetic acid Chemical Properties,Usage,Production
Uses
6-Bromo-2-pyridineacetic Acid is used in preparation of pyrimidine derivatives as RORγ modulators.
Synthesis
955369-63-8
1093879-46-9
The general procedure for the synthesis of 2-bromo-6-pyridylacetic acid from ethyl (6-bromopyridin-2-yl)acetate was as follows: to a mixed solution of THF (10 mL), water (10 mL), and MeOH (20 mL) containing ethyl 2-(6-bromo-2-pyridinyl)acetate (2.00 g, 8.19 mmol) was added LiOH-H2O (1.03 g, 24.5 mmol). Subsequently, the reaction mixture was stirred at 20 °C for 2 hours. After completion of the reaction, the mixture was concentrated in vacuum. The residue was acidified with 1.0 N HCl to pH=3.0, washed with water (150 mL) and extracted with ethyl acetate (3 x 150 mL). The organic layers were combined, dried with Na2SO4, filtered and concentrated in vacuum to give 2-bromo-6-pyridineacetic acid (1.70 g, 96% yield) as a light yellow solid. The product was characterized by 1H NMR (400 MHz, DMSO-d6): δ=12.63 (br.s, 1H), 7.86-7.71 (m, 1H), 7.59 (d, J=8.0 Hz, 1H), 7.46 (d, J=7.6 Hz, 1H), 3.81 (s, 2H).
References
[1] Patent: WO2018/106636, 2018, A1. Location in patent: Paragraph 00239
[2] Journal of Organic Chemistry, 2018, vol. 83, # 16, p. 9088 - 9095
2-(6-bromopyridin-2-yl)acetic acid Preparation Products And Raw materials
Raw materials
Preparation Products
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