(3S)-3-Ammonio-3-(3-methylphenyl)propanoate

Basic Information

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CAS Number

701907-44-0

Molecular Formula

C10H13NO2

Molecular Weight

179.22 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Amines

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Melting Point

210-212°C

Boiling Point

322.3°C at 760 mmHg

Density

1.163

Flash Point

148.7°C

Refractive Index

1.567

SMILES

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

InChI

InChI=1S/C10H13NO2/c1-7-3-2-4-8(5-7)9(11)6-10(12)13/h2-5,9H,6,11H2,1H3,(H,12,13)/t9-/m0/s1

InChIKey

HMLYKNGYKKJNLC-VIFPVBQESA-N

LogP

1.4695200000000002

Topological Polar Surface Area

63.32000000000001 Å²

Hydrogen Bond Donor/Acceptor

3 / 3

Complexity

182

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

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

Synonyms & References

English

MFCD04113692
(s)-3-amino-3-(3-methylphenyl)propionic acid
AS-38520
(3S)-3-amino-3-(3-methylphenyl)propanoic acid
A902154
(s)-3-amino-3-(3-methyl-phenyl)-propanoic acid
EN300-1286877
(S)-3-amino-3-(3-methylphenyl)propanoic acid
(S)-3-Amino-3-(m-tolyl)propanoicacid
(s)-3-(m-tolyl)-beta-alanine
(s)-3-amino-3-(3-methyl-phenyl)-propionic acid
(s)-beta-(m-tolyl)alanine
benzenepropanoic acid, beta-amino-3-methyl-, (betas)-
CS-0135740
(S)-3-AMINO-3-M-TOLYLPROPANOIC ACID
(s)-3-amino-3-m-tolyl-propionic acid
Benzenepropanoic acid, b-amino-3-methyl-, (bS)-
S-3-Amino-3-(3-methyl-phenyl)-propionic acid
AC-25393
701907-44-0
DTXSID30426158
(S)- -(m-Tolyl)alanine
h-d-phg(3-me)-(c*ch2)oh
(S)-3-amino-3-(3-methyl-phenyl)-propionic acid, AldrichCPR
(S)-3-Amino-3-(m-tolyl)propanoic acid
AKOS010393199
h-beta-phe(3-me)-oh
(S)-?-(m-Tolyl)alanine
(S)-3-Amino-3-(3-methylphenyl)propanoic acid
(S)-3-Amino-3-(3-methylphenyl)-propionic acid
(S)-3-AMINO-3-(3-METHYLPHENYL)PROPIONIC ACID,

MDL Number

MFCD04113692

FAQ

What regulatory guidelines apply to (3S)-3-Ammonio-3-(3-methylphenyl)propanoate (CAS: 701907-44-0)?

Regulatory guidelines for (3S)-3-Ammonio-3-(3-methylphenyl)propanoate (CAS: 701907-44-0) include GHS classification for hazardous chemicals, REACH regulations for EU manufacturers and importers, and FDA/EPA requirements for safety and environmental impacts. It is important to follow local regulations for storage, handling, and disposal to ensure compliance.

Are there alternatives to (3S)-3-Ammonio-3-(3-methylphenyl)propanoate (CAS: 701907-44-0) in synthesis?

There are several alternatives to (3S)-3-Ammonio-3-(3-methylphenyl)propanoate (CAS: 701907-44-0) in synthesis, such as (3R)-3-ammonio-3-(3-methylphenyl)propanoate and other similar analogs. Common alternative reagents include methyl esters and other amine compounds. These alternatives can offer similar functionalities with different chemical properties.

What is the market or research trend for (3S)-3-Ammonio-3-(3-methylphenyl)propanoate (CAS: 701907-44-0)?

The market for (3S)-3-Ammonio-3-(3-methylphenyl)propanoate (CAS: 701907-44-0) is growing due to its applications in personal care and pharmaceutical industries. Research trends focus on its potential as a surfactant and its use in developing new drug delivery systems. Market demand is expected to increase as more applications are discovered.

How should waste containing (3S)-3-Ammonio-3-(3-methylphenyl)propanoate (CAS: 701907-44-0) be handled?

Waste containing (3S)-3-Ammonio-3-(3-methylphenyl)propanoate (CAS: 701907-44-0) should be collected in appropriate containers and disposed of through incineration or professional waste disposal services. Environmental protection precautions include using barriers to prevent leaks and ensuring proper ventilation. It is crucial to follow local regulations for safe waste management and disposal.