Methyl N-phenylglycinate hydrochloride (1:1)

Basic Information

View in Editor

CAS Number

515028-39-4

Molecular Formula

C9H12ClNO2

Molecular Weight

201.65 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

SMILES

View in Editor

COC(=O)CNC1=CC=CC=C1.Cl

InChI

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

InChIKey

AJHZGVMKIXHMNP-UHFFFAOYSA-N

LogP

1.6932999999999998

Topological Polar Surface Area

38.33 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

142

Synonyms & References

English

AJHZGVMKIXHMNP-UHFFFAOYSA-N
phenyl-glycine methyl ester hydrochloride
methyl2-(phenylamino)acetatehydrochloride
AS-57817
SCHEMBL76327
A809027
phenyl glycine methyl ester-hcl
515028-39-4
methyl 2-(phenylamino)acetate hydrochloride
CS-0262026
methyl 2-phenylazanylethanoate hydrochloride
Z1250132387
2-anilinoacetic acid methyl ester hydrochloride
AKOS008030912
EN300-80938
methyl (+/-)-phenylglycinate hydrochloride
78733-46-7
phenylglycine methyl ester HCl
methyl 2-anilinoacetate;hydrochloride
GenBank AX727681 (9CI)
AM82657
FT-0688104
N-phenylglycine methyl ester hydrochloride
H-PHG-OME·HCL
L-PHENYLGLYCINE METHYL ESTER HYDROCHLORIDE

MDL Number

MFCD00077158

FAQ

What are the physical and chemical properties of Methyl N-phenylglycinate hydrochloride (CAS: 515028-39-4)?

Methyl N-phenylglycinate hydrochloride (CAS: 515028-39-4) is a white crystalline solid with a molecular weight of approximately 218.3 g/mol. It is slightly soluble in water and highly soluble in organic solvents such as ethanol and acetone. This compound is stable under neutral and slightly acidic conditions but may hydrolyze in strongly alkaline environments. It is not reactive with common reagents but should be handled with care to avoid strong bases.

How is Methyl N-phenylglycinate hydrochloride (CAS: 515028-39-4) typically synthesized?

Methyl N-phenylglycinate hydrochloride (CAS: 515028-39-4) is typically synthesized by the reaction of methyl glycinate with phenol in the presence of a strong acid catalyst such as hydrochloric acid. The reaction involves esterification followed by acid hydrolysis to form the hydrochloride salt. Conditions are controlled to achieve high selectivity and yield, often conducted under reflux and monitored using thin-layer chromatography (TLC).

What industries use Methyl N-phenylglycinate hydrochloride (CAS: 515028-39-4)?

Methyl N-phenylglycinate hydrochloride (CAS: 515028-39-4) is used in various industries, including pharmaceuticals, where it serves as a precursor for the synthesis of certain drugs. It is also utilized in the production of semiconductors as a dopant and in polymer synthesis as a monomer. Additionally, it finds application in the development of sensors and as a chemical reagent in analytical chemistry.

What precautions should be taken when handling Methyl N-phenylglycinate hydrochloride (CAS: 515028-39-4)?

When handling Methyl N-phenylglycinate hydrochloride (CAS: 515028-39-4), it is important to wear appropriate personal protective equipment (PPE) such as gloves, protective goggles, and a lab coat. This compound should be stored in a cool, dry place away from strong bases and acids. In case of spill, it should be cleaned up carefully using appropriate absorbent materials. For detailed safety information, refer to the Material Safety Data Sheet (MSDS) or Safety Data Sheet (SDS) for this compound.