Methoxamine Impurity 3 (3,4-Dimethoxyphenylacetone)

Basic Information

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CAS Number

776-99-8

Molecular Formula

C11H14O3

Molecular Weight

194.23 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Boiling Point

167°C/17mmHg

Density

1.115

Water Solubility

Insoluble in water.

Flash Point

>230 °F

Refractive Index

1.5338-1.5358

SMILES

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CC(=O)CC1=CC(=C(C=C1)OC)OC

InChI

InChI=1S/C11H14O3/c1-8(12)6-9-4-5-10(13-2)11(7-9)14-3/h4-5,7H,6H2,1-3H3

InChIKey

UMYZWICEDUEWIM-UHFFFAOYSA-N

LogP

1.8353

Topological Polar Surface Area

35.53 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

191

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

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

NSC 16700
F0001-2009
V0052
3,4-Dimethoxybenzyl methyl ketone
AC-11717
DTXSID00228267
A839164
FT-0614352
3,4-Dimethoxyphenylacetone
NS00022779
3,4-dimethoxyphenylactone
(3,4-dimethoxyphenyl) acetone
3,4-dimethoxyphenyl acetone
BRN 1107410
MFCD00008772
776-99-8
1-(3,4-dimethoxyphenyl)-propan-2-one
3,4-Dimethoxyphenyl-acetone
1-(3,4-dimethoxyphenyl)propan-2-one
Veratryl acetone
(3,4-Dimethoxyphenyl)acetone, 97%
(3,4-Dimethoxyphenyl)acetone
AS-14511
UNII-DM28QN9QDY
CHEMBL1163509
NSC-16700
EN300-20785
AKOS000120862
SCHEMBL187562
W-104303
methyl 3,4-dimethoxyphenylmethyl ketone

MDL Number

MFCD00008772

Customs Code

2914509090

FAQ

What is Methoxamine Impurity 3 (CAS: 776-99-8)?

Methoxamine Impurity 3, also known as 3,4-Dimethoxyphenylacetone, is an organic compound with the molecular formula C10H12O3. It is a white crystalline solid with moderate solubility in polar solvents and is commonly encountered as an impurity during the synthesis of methoxamine. Its chemical structure features a phenyl ring substituted with methoxy groups at positions 3 and 4, linked to an acetone functional group. This compound is relevant in pharmaceutical and analytical chemistry contexts due to its association with methoxamine, a compound used in drug development.

What are the main uses of Methoxamine Impurity 3 (CAS: 776-99-8)?

Methoxamine Impurity 3 (CAS: 776-99-8) is primarily used in pharmaceutical research for purity analysis and as a byproduct in the synthesis of methoxamine. It may also serve as an intermediate in organic chemistry processes, aiding in the development of other compounds. Additionally, it is studied in quality control to ensure the safety and efficacy of methoxamine-containing drugs. Its applications extend to chemical synthesis and research, particularly in understanding impurity profiles in drug manufacturing.

Is Methoxamine Impurity 3 (CAS: 776-99-8) safe?

Methoxamine Impurity 3 (CAS: 776-99-8) should be handled with caution due to potential toxicity. While specific safety data may vary, it is advisable to use personal protective equipment (PPE) such as gloves and goggles when working with this compound. Proper ventilation is recommended to minimize inhalation risks. Safety standards for handling impurities in chemical synthesis emphasize adherence to lab protocols, including avoiding skin contact and following guidelines outlined in safety data sheets (SDS) for detailed information.

How should Methoxamine Impurity 3 (CAS: 776-99-8) be stored?

Methoxamine Impurity 3 (CAS: 776-99-8) should be stored in a cool, dry place, preferably at 2-8°C, to maintain stability. It requires protection from light and moisture, so storage in a sealed, airtight container is essential. Avoid exposure to air to prevent degradation. Proper storage conditions ensure the compound remains viable for analytical or research purposes, aligning with standard practices for handling organic impurities.