3-Amino-3-(4-methoxyphenyl)propanoic acid

Basic Information

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CAS Number

5678-45-5

Molecular Formula

C10H13NO3

Molecular Weight

195.22 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Amines

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Melting Point

232°C(dec.)

Boiling Point

331.88°C (rough estimate)

Refractive Index

1.5150 (estimate)

SMILES

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COC1=CC=C(C=C1)C(CC(=O)O)N

InChI

InChI=1S/C10H13NO3/c1-14-8-4-2-7(3-5-8)9(11)6-10(12)13/h2-5,9H,6,11H2,1H3,(H,12,13)

InChIKey

NYTANCDDCQVQHG-UHFFFAOYSA-N

LogP

1.1697

Topological Polar Surface Area

72.55 Å²

Hydrogen Bond Donor/Acceptor

3 / 4

Complexity

188

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H332 Harmful if inhaled
Acute toxicity, inhalation

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

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

3-amino-3-(4-methoxyphenyl)propanoicacid
SY007346
EN300-22836
AMY20243
AKOS016043233
7R-0624
FT-0614944
AB04473
TimTec1_004269
CHEMBL4173325
A-(p-methoxyphenyl)alanine
dl-3-amino-3-(4-methoxy-phenyl)-propionic acid
HMS1546C01
DTXSID20927321
dl-beta-(p-methoxyphenyl)alanine
EU-0066634
3-amino-3-(4'-methoxyphenyl)propionic acid
3-Amino-3-(4-methoxy-phenyl)-propionic acid
5678-45-5
SCHEMBL2452463
.beta.-Amino-p-methoxyhydrocinnamic acid
FT-0630096
J-511578
MFCD00187209
3-amino-3-(4-methoxyphenyl)propanoic acid
A8118
BB 0249704
3-Amino-3-(4-methoxy-phenyl)-propionic acid
Oprea1_156707
3-amino-3-(p-methoxyphenyl)propionic acid
3-amino-3-(4-methoxyphenyl)-propionic acid

MDL Number

MFCD00187209

Customs Code

2922509090

FAQ

What is 3-Amino-3-(4-methoxyphenyl)propanoic acid (CAS: 5678-45-5)?

3-Amino-3-(4-methoxyphenyl)propanoic acid (CAS: 5678-45-5) is an aromatic amino acid derivative with a molecular formula of C9H13NO3. It is a colorless to white crystalline powder with a pKa of approximately 4.5. This compound is characterized by its solubility in water and its potential for use in pharmaceuticals and research.

What are the main uses of 3-Amino-3-(4-methoxyphenyl)propanoic acid (CAS: 5678-45-5)?

3-Amino-3-(4-methoxyphenyl)propanoic acid (CAS: 5678-45-5) is primarily used as a precursor in the synthesis of pharmaceuticals and bioactive compounds. It finds applications in research for studying metabolic pathways and as a building block in organic synthesis.

Is 3-Amino-3-(4-methoxyphenyl)propanoic acid (CAS: 5678-45-5) safe?

3-Amino-3-(4-methoxyphenyl)propanoic acid (CAS: 5678-45-5) is generally considered safe for laboratory use when handled with appropriate precautions. However, it is important to follow recommended safety guidelines, including the use of gloves and protective eyewear to avoid skin and eye contact. Storage in a cool, dry place away from direct sunlight is also recommended.

How should 3-Amino-3-(4-methoxyphenyl)propanoic acid (CAS: 5678-45-5) be stored?

3-Amino-3-(4-methoxyphenyl)propanoic acid (CAS: 5678-45-5) should be stored in a cool, dry place away from direct sunlight and heat sources to maintain its stability. It is recommended to store the compound in a tightly closed container to prevent moisture absorption and degradation. Proper labeling is advised to ensure its safe handling.