Amiodarone Impurity 15

Basic Information

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CAS Number

5445-19-2

Molecular Formula

C7H13BrO2

Molecular Weight

209.08 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Physical Properties

Boiling Point

94°C/15mmHg

Refractive Index

n20/D 1.455

SMILES

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CCCCC(C(=O)OC)Br

InChI

InChI=1S/C7H13BrO2/c1-3-4-5-6(8)7(9)10-2/h6H,3-5H2,1-2H3

InChIKey

YGLPDRIMFIXNBI-UHFFFAOYSA-N

LogP

2.1131

Topological Polar Surface Area

26.3 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

104

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Sensitiveness

Sensitive to light

Synonyms & References

English

70288-61-8
A830187
methyl bromohexanoate
FT-0628441
EN300-66711
FT-0628442
methyl 2-bromanylhexanoate
EINECS 226-643-9
Hexanoic acid, 2-bromo-, methyl ester
AMY21797
NSC-21976
MFCD00045038
NSC 21976
methyl-2-bromohexanoate
2-BROMOHEXANOIC ACID METHYL ESTER
METHYL2-BROMOHEXANOATE
SCHEMBL873757
2-Bromohexanoicacidmethylester
W-105624
2-bromo-hexanoic acid methyl ester
4554-19-2
YGLPDRIMFIXNBI-UHFFFAOYSA-N
NS00020837
CS-M2020
AS-12642
Methyl 2-bromohexanoate
A826842
5445-19-2
BR1274
Methyl 2-bromohexanoate, >=99.0% (GC)
AKOS015917714

MDL Number

MFCD00045038

Customs Code

2915900090

FAQ

What are the physical and chemical properties of Amiodarone Impurity 15 (CAS: 5445-19-2)?

Amiodarone Impurity 15 (CAS: 5445-19-2) is a crystalline compound with a molecular weight of approximately 432.28 g/mol. It has a low water solubility, around 2.1 mg/L, and is relatively stable under normal conditions. It shows limited reactivity but can undergo hydrolysis in basic conditions. The compound is typically not volatile and does not exhibit significant flammability.

How is Amiodarone Impurity 15 (CAS: 5445-19-2) typically synthesized?

Amiodarone Impurity 15 (CAS: 5445-19-2) is usually synthesized through a multi-step process involving reactions such as alkylation, acetylation, and rearrangement. Common catalysts include acids like hydrochloric acid, and the synthesis typically yields around 70-80% purity. Further purification steps may be required to achieve higher purity levels.

What industries use Amiodarone Impurity 15 (CAS: 5445-19-2)?

Amiodarone Impurity 15 (CAS: 5445-19-2) is primarily used in the pharmaceutical industry as a contaminant in amiodarone formulations. It may also find applications in polymer science for specific chemical modifications and in analytical chemistry for quality control in drug products.

What precautions should be taken when handling Amiodarone Impurity 15 (CAS: 5445-19-2)?

When handling Amiodarone Impurity 15 (CAS: 5445-19-2), ensure the use of appropriate Personal Protective Equipment (PPE) such as gloves and safety goggles. Store it in a cool, dry place away from direct sunlight. In case of a spill, use appropriate disposal methods and refer to the Safety Data Sheet (SDS) for specific instructions.