5-(Benzyloxy)-2-bromopyridine

Basic Information

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CAS Number

630120-99-9

Molecular Formula

C12H10BrNO

Molecular Weight

264.12 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

SMILES

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C1=CC=C(C=C1)COC2=CN=C(C=C2)Br

InChI

InChI=1S/C12H10BrNO/c13-12-7-6-11(8-14-12)15-9-10-4-2-1-3-5-10/h1-8H,9H2

InChIKey

KKCMCYRLJVVNTQ-UHFFFAOYSA-N

LogP

3.4231000000000016

Topological Polar Surface Area

22.12 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

183

Synonyms & References

English

5-Benzyloxy-2-bromopyridine
MB10387
MFCD11874623
SCHEMBL1103901
Pyridine, 2-bromo-5-(phenylmethoxy)-
630120-99-9
FT-0748822
2-bromo-5-[(phenylmethyl)oxy]pyridine
5-Benzyloxy-2-bromo-pyridine
KKCMCYRLJVVNTQ-UHFFFAOYSA-N
HDH-PHARMA 24754
AKOS022176090
HDH-PHARMA
CS-0046861
A868273
2-bromo-5-phenylmethoxypyridine
SY111458
DS-7683
DTXSID70582429
5-(Benzyloxy)-2-bromopyridine
PYRIDINE,2-BROMO-5-(PHENYLMETHOXY)-
2-BROMO-5-(PHENYLMETHOXY)-PYRIDINE
2-bromo-5-benzyloxypyridine
Pyridine,2-bromo-5-(phenylmethoxy)
2-Bromo-5-(benzyloxy)pyridine
AK143482
Z0742
ST

MDL Number

MFCD11874623

Customs Code

2933399090

FAQ

What are the physical and chemical properties of 5-(Benzyloxy)-2-bromopyridine (CAS: 630120-99-9)?

5-(Benzyloxy)-2-bromopyridine is a crystalline solid with a molecular weight of approximately 286.03 g/mol. It has a solubility of about 0.1 g/L in water and is slightly soluble in common organic solvents like ethanol and acetone. This compound is reactive towards nucleophiles and is prone to substitution reactions. It is used in synthetic organic chemistry as a starting material and intermediate.

How is 5-(Benzyloxy)-2-bromopyridine (CAS: 630120-99-9) typically synthesized?

5-(Benzyloxy)-2-bromopyridine is typically synthesized through a multi-step process involving the protection of a pyridine ring with benzyloxy group followed by bromination. Commonly, benzyl bromide reacts with 2-hydroxy-5-pyridinecarboxylic acid to form the benzyloxy derivative. The bromination step is often carried out using N-bromosuccinimide (NBS) or hydrogen bromide in the presence of a catalyst like azobisisobutyronitrile (AIBN).

What industries use 5-(Benzyloxy)-2-bromopyridine (CAS: 630120-99-9)?

5-(Benzyloxy)-2-bromopyridine is primarily used in the pharmaceutical and chemical industries as an intermediate for the synthesis of various drugs and materials. It plays a crucial role in the development of new chemical entities and polymers, as well as in the production of sensors and semiconductors.

What precautions should be taken when handling 5-(Benzyloxy)-2-bromopyridine (CAS: 630120-99-9)?

Proper personal protective equipment (PPE) including gloves, goggles, and a lab coat should be worn when handling 5-(Benzyloxy)-2-bromopyridine. The compound should be handled in a well-ventilated fume hood due to its reactivity. In case of a spill, it should be cleaned up with absorbent material and disposed of according to local regulations. For detailed safety information, a Material Safety Data Sheet (MSDS) should be consulted.