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Compound Information

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Structure

Product Name

4-[4-(dimethyl amino)-1-(4- Fluoro phenyl)-1-
hydroxy butyl]-3-(Hydroxy methyl)-benzonitrile
hydrbromide (CAS No. 103146-26-5)

CAS No.

103146-26-5

PropertyDetails
Product Name4-[4-(dimethyl amino)-1-(4- Fluoro phenyl)-1-
hydroxy butyl]-3-(Hydroxy methyl)-benzonitrile
hydrbromide (CAS No. 103146-26-5)
Structure
CAS No.CAS No. 103146-26-5
Related to PharmaCitalopram/Escitalopram
Molecular FormulaC20H24BrFN2O2
Formula Weight423.32
Storage ConditionAmbient

Compound Specification

PropertyDetails
DescriptionOff-White to White color powder
Identification by HPLCThe Retention time of the principle peak in the
sample should match with the retention time of
working standard
Chromatographic purity by HPLC (% in area normalization)
PurityNot less than 99.0%

SDS Information

Product Identification

Chemical Name           : 4-[4-(Dimethylamino)-1-(4-fluorophenyl)-1-hydroxybutyl]-3-(hydroxymethyl)benzonitrile hydrobromide
CAS No                          : 103146-26-5
Molecular Weight       : 423.3
Chemical Formula      : C20H23FN2O2.BrH

Composition/Information on Ingredients

IngredientCAS NoClassificationConcentration
4-[4-(Dimethylamino)-1-(4-fluorophenyl)-1-
hydroxybutyl]-3-(hydroxymethyl)benzonitrile
hydrobromide

103146-26-5

≤ 100

Hazards Identification

3.1 Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS):
No data.
3.2 GHS Label elements, including precautionary statements:
No known hazard.

First Aid Measures Eyes

4.1 Description of first aid measures
General advice: Consult a physician. Show this safety data sheet to the doctor in attendance. Move
out of dangerous area.
If inhaled: Remove victim to fresh air. In severe cases or if symptoms persist, seek medical attention.
In case of skin contact: Immediately wash skin with copious amounts of water for at least 15
minutes while re-moving contaminated clothing and shoes. If irritation persists, seek medical
attention.

In case of eye contact: Immediately flush with plenty of water. After initial flushing, remove any
contact lenses and continue flushing for at least 15 minutes. Keep eye wide open while rinsing. Get
medical attention.
If swallowed: Wash out mouth with copious amounts of water for at least 15 minutes. Seek medical
attention.
4.2 Most important symptoms and effects, both acute and delayed
See Section 2.2 and/or in Section 11
4.3 Indication of any immediate medical attention and special treatment needed:
No data available

Fire Fighting Measures

5.1. Extinguishing media: Use dry sand, dry chemical or alcohol-resistant foam for extinction.
5.2. Special hazards arising from the substance or mixture: Carbon monoxide, nitrogen oxides,
hydrogen fluoride, hydrogen bromide.
5.3. Advice for firefighters: Wear self-contained breathing apparatus for firefighting if necessary.
5.4. Further information: No data available.

Accidental Release Measures

6.1 Personal precautions, protective equipment and emergency procedures
Ensure adequate ventilation. Use personal protective equipment.
6.2 Environmental precautions
Should not be released into the environment. See Section 12 for additional ecological information
6.3 Methods and materials for containment and cleaning up
Sweep up or vacuum up spillage and collect in suitable container for disposal.
6.4 Reference to other sections: Refer to protective measures listed in Sections 8 and 13.

Handling and Storage

7.1 Precautions for safe handling: Avoid contact with skin and eyes. Avoid inhalation of vapor
or mist. Keep away from sources of ignition – No smoking. Take measures to prevent the buildup
of electro-static charge. For precautions see section 2.2
7.2 Conditions for safe storage, including any incompatibilities: Keep container tightly closed
in a dry and well-ventilated place at Ambient. Containers which are opened must be carefully
resealed and kept upright to prevent leakage.
7.3 Specific end use(s): Laboratory chemicals, for scientific research and development only.

Exposure Controls/Personal Protection

8.1 Control parameters:
Components with workplace control parameters: Contains no substances with occupational

exposure limit values.

8.2 Exposure controls:
Appropriate engineering controls
Ensure that eyewash stations and safety showers are close to the workstation location. Ensure
adequate ventilation, especially in confined areas
Personal protective equipment:
Eye/face protection: Wear appropriate protective eyeglasses or chemical safety goggles as
described by OSHA’s eye and face protection regulations in 29 CFR 1910.133 or European
Standard EN166.
Skin protection: Handle with gloves. Gloves must be inspected prior to use. Use proper
glove removal technique (without touching glove’s outer surface) to avoid skin contact with
this product. Dispose of contaminated gloves after use in accordance with applicable laws and
good laboratory practices. Wash and dry hands
Body Protection: Complete suit protecting against chemicals, Flame retardant antistatic
protective clothing., The type of protective equipment must be selected according to the
concentration and amount of the dangerous substance at the specific workplace

Control of environmental exposure: Prevent further leakage or spillage if safe to do so. Do
not let product enter drains.

Physical and Chemical Properties

a) Appearance Solid
b) Odour Off-White to White color powder
c) Odour Threshold No data available
d) pH No data available
e) Melting point/freezing point 200 – 210◦C
f) Initial boiling point and boiling range No data available
g) Flash point No data available
h) Evaporation rate No data available
i) Flammability (solid, gas) No data available
j) Upper/lower flammability or explosive limits No data available
k) Vapour pressure No data available
l) Vapour density No data available
m) Relative density No data available
n) Water solubility No data available
o) Partition coefficient: n-octanol/water No data available
p) Auto-ignition temperature No data available
q) Decomposition temperature No data available
r) Viscosity No data available
s) Explosive properties No data available
t) Oxidizing properties No data available
9.2. Other safety information:
Formula C20H23FN2O2.BrH
Molecular weight 423.3
CAS Number 103146-26-5

Stability and Reactivity

10.1 Reactivity: No data available
10.2 Chemical stability: Stable under recommended storage conditions.
10.3 Possibility of hazardous reactions: No data available
10.4 Conditions to avoid: Not data available
10.5 Incompatible materials: Not data available
10.6 Hazardous decomposition products:
Hazardous decomposition products formed under fire conditions: Carbon monoxide, nitrogen
oxides, hydrogen flu-oride, hydrogen bromide.

Toxicological Information

No data available

Ecological Information

Not available.

Disposal Considerations

13.1 Waste treatment methods
Product: Product Arrange disposal as special waste, by licensed disposal company, in consultation
with local waste disposal authority, in accordance with national and regional regulations.
Contaminated packaging: Dispose of as unused product.

Transport Information

DOT (US), IMDG and IATA: No known hazard for air and ground transportation.

Regulatory Information

No chemicals in this material are subject to the reporting requirements of SARA Title III, Section 302, or have known CAS numbers that exceed the threshold reporting levels established by SARA Title III, Section 313.

Other Information

The information above is believed to be accurate and represents the best information currently available to us.