Agomelatine Impurity 5

Basic Information

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CAS Number

138113-08-3

Molecular Formula

C13H11NO

Molecular Weight

197.23 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Nitriles

Basic Physical Properties

Physical State

Powder

Melting Point

82.0 to 85.0 deg-C

Boiling Point

374.3°C at 760 mmHg

SMILES

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COC1=CC2=C(C=CC=C2CC#N)C=C1

InChI

InChI=1S/C13H11NO/c1-15-12-6-5-10-3-2-4-11(7-8-14)13(10)9-12/h2-6,9H,7H2,1H3

InChIKey

PYJMGUQHJINLLD-UHFFFAOYSA-N

Complexity

255

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

Hazard Class

Class 6.1 Class 6.1

Synonyms & References

English

7-Methoxy-1-naphthylmethylcyanide
FT-0651955
138113-08-3
M2421
(7-Methoxy-1-naphthyl)acetonitrile
SY033192
AM20090762
(7-Methoxy-naphthalen-1-yl)acetonitrile
CS-0097958
AKOS006288808
(7-methoxynaphthalen-1-yl)acetonitrile
EN300-117143
(7-methoxy-naphthalen-1-yl)-acetonitrile
(7-Methoxy-naphth-1-yl)acetonitrile
2-(7-methoxynaphthalen-1-yl)acetonitrile
AC-24009
PALMITELAIDICACID
1-Cyanomethyl-7-methoxynaphthalene;2-(7-Methoxy-1-naphthyl)acetonitrile;7-Methoxy-1-naphthaleneacetinitrile
2-(7-Methoxy-1-naphthyl)acetonitrile
1-Naphthaleneacetonitrile, 7-methoxy-
MFCD08704309
BCP07368
NS00077840
(7-Methoxynaphth-1-yl)acetonitrile
PYJMGUQHJINLLD-UHFFFAOYSA-N
A25610
7-methoxy-1-naphthaleneacetonitrile
DTXSID90460472
7-Methoxy-1-naphthylacetonitrile
7-Methoxy-1-naphthaleneacetinitrile
Q-102532

MDL Number

MFCD08704309

FAQ

What is Agomelatine Impurity 5 (CAS: 138113-08-3)?

Agomelatine Impurity 5, with CAS number 138113-08-3, is a trace impurity associated with the antidepressant drug Agomelatine. It is typically identified during the synthesis or purification process and may have a molecular structure similar to the parent compound. This impurity is not intended for therapeutic use but is monitored for quality control purposes in pharmaceutical manufacturing.

What are the main uses of Agomelatine Impurity 5 (CAS: 138113-08-3)?

Agomelatine Impurity 5 is primarily used in pharmaceutical research and quality control to ensure the purity of Agomelatine. It may also serve as a reference standard for analytical testing. While not used in clinical applications, it plays a critical role in the development and regulation of antidepressant medications.

Is Agomelatine Impurity 5 (CAS: 138113-08-3) safe?

Agomelatine Impurity 5 is generally considered safe when handled in controlled laboratory settings. However, as with any chemical, proper safety measures should be followed, including the use of personal protective equipment (PPE) and adherence to standard operating procedures (SOPs). It is not classified as hazardous for typical exposure levels but should be treated with caution during handling and disposal.

How should Agomelatine Impurity 5 (CAS: 138113-08-3) be stored?

Agomelatine Impurity 5 should be stored in a cool, dry, and dark place, away from moisture and light. It is recommended to keep it in a sealed container at a temperature below 25°C. Proper storage conditions help maintain its chemical stability and prevent degradation during handling and analysis.