Skip to Content
Merck

479993

Sigma-Aldrich

Methyl 4-(aminomethyl)benzoate hydrochloride

97%

Sign Into View Organizational & Contract Pricing

Select a Size


Select a Size

Change View

About This Item

Linear Formula:
H2NCH2C6H4CO2CH3·HCl
CAS Number:
Molecular Weight:
201.65
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Quality Level

Assay

97%

mp

243 °C (dec.) (lit.)

functional group

amine
ester

SMILES string

Cl.COC(=O)c1ccc(CN)cc1

InChI

1S/C9H11NO2.ClH/c1-12-9(11)8-4-2-7(6-10)3-5-8;/h2-5H,6,10H2,1H3;1H

InChI key

GIZCKBSSWNIUMZ-UHFFFAOYSA-N

General description

Methyl 4-(aminomethyl)benzoate hydrochloride is an amino acid ester hydrochloride. Its synthesis by esterification reaction has been reported.[1] It plays a role during the preparation of a novel hepatitis C virus (HCV) helicase inhibitor.[2]

Application

Methyl 4-(aminomethyl)benzoate hydrochloride may be used in the preparation of methyl 4-((3-butyl-3-phenylureido)methyl)benzoate.[3]

Pictograms

Exclamation mark

Signal Word

Warning

Hazard Statements

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable


Choose from one of the most recent versions:

Certificates of Analysis (COA)

Lot/Batch Number

Don't see the Right Version?

If you require a particular version, you can look up a specific certificate by the Lot or Batch number.

Already Own This Product?

Find documentation for the products that you have recently purchased in the Document Library.

Visit the Document Library

Sahar Kandil et al.
Bioorganic & medicinal chemistry letters, 19(11), 2935-2937 (2009-05-06)
Herein we report a successful application of a computer-aided design approach to identify a novel HCV helicase inhibitor. A de novo drug design methodology was used to generate an initial set of structures that could potentially bind to a putative
Joel A Bergman et al.
Journal of medicinal chemistry, 55(22), 9891-9899 (2012-09-27)
The incidence of malignant melanoma has dramatically increased in recent years thus requiring the need for improved therapeutic strategies. In our efforts to design selective histone deactylase inhibitors (HDACI), we discovered that the aryl urea 1 is a modestly potent
Xiaolin Ge et al.
Nature communications, 9(1), 2297-2297 (2018-06-14)
Synthetic polyelectrolytes, capable of fast transporting protons, represent a challenging target for membrane engineering in so many fields, for example, fuel cells, redox flow batteries, etc. Inspired by the fast advance in molecular machines, here we report a rotaxane based
Jiabo Li et al.
Molecules (Basel, Switzerland), 13(5), 1111-1119 (2008-06-19)
A series of amino acid methyl ester hydrochlorides were prepared in good to excellent yields by the room temperature reaction of amino acids with methanol in the presence of trimethylchlorosilane. This method is not only compatible with natural amino acids

Our team of scientists has experience in all areas of research including Life Science, Material Science, Chemical Synthesis, Chromatography, Analytical and many others.

Contact Technical Service