trans-4-Phenyl-L-proline hydrochloride

Basic Information

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CAS Number

90657-53-7

Molecular Formula

C11H14ClNO2

Molecular Weight

227.69 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

134-140 ºC

Specific Rotation

+17.5° ( c=1, 2N HCl)

SMILES

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C1C(CNC1C(=O)O)C2=CC=CC=C2.Cl

InChI

InChI=1S/C11H13NO2.ClH/c13-11(14)10-6-9(7-12-10)8-4-2-1-3-5-8;/h1-5,9-10,12H,6-7H2,(H,13,14);1H/t9-,10+;/m1./s1

InChIKey

LWFBRHSTNWMMGN-UXQCFNEQSA-N

LogP

1.6385

Topological Polar Surface Area

49.33 Å²

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

211

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

(2S,4S)-4-Phenylpyrrolidine-2-carboxylic acid hydrochloride
H-Tic-OMe.HCl
TRANS-4-PHENYL-L-PROLINE HYDROCHLORIDE
4-trans-4-Phenyl-L-proline hydrochloride
Trans-4-phenyl-l-proline HCl
L-Proline,4-phenyl-, hydrochloride, (4S)- (9CI)
L-Proline, 4-phenyl-, hydrochloride,trans-
(2S,4S)-4-PHENYLPYRROLIDINE-2-CARBOXYLIC ACID HCL
ZB1690
VZ33949
S360
AB0018591
AX8013200
ST24026186
L-Proline, 4-phenyl-, hydrochloride, trans-
657P537
(4S)-4-Phenyl-L-proline--hydrogen chloride (1/1)
L-Prol
L-Proline, 4-phenyl-, hydrochloride, (4S)- (9CI)
L-Proline, 4-phenyl-, hydrochloride, trans- (ZCI)
(2S,4S)-4-phenylpyrrolidine-2-carboxylic acid hydrochloride
trans-4-phenyl-l-proline hcl
(2S,4S)-4-phenylpyrrolidine-2-carboxylic acid;hydrochloride
EN300-7377902
DTXSID10678234
J-501054
90657-53-7
SCHEMBL25365081
AC-7635
MFCD08061932
CS-W022754

MDL Number

MFCD08061932

FAQ

What are the physical and chemical properties of trans-4-Phenyl-L-proline hydrochloride (CAS: 90657-53-7)?

Trans-4-Phenyl-L-proline hydrochloride is a white crystalline solid with a molecular weight of approximately 237.24 g/mol. It is slightly soluble in water and ethanol. Chemically, it is stable under normal conditions but can react with strong bases to form the corresponding amine. Its reactivity is moderate, making it useful in various synthetic applications.

How is trans-4-Phenyl-L-proline hydrochloride (CAS: 90657-53-7) typically synthesized?

Trans-4-Phenyl-L-proline hydrochloride is typically synthesized by reacting L-proline with phenyl isocyanate in the presence of an appropriate catalyst. The reaction is carried out under mild conditions, and the yield is generally around 75-80%. The product is isolated by recrystallization from water or alcohol.

What industries use trans-4-Phenyl-L-proline hydrochloride (CAS: 90657-53-7)?

Trans-4-Phenyl-L-proline hydrochloride is used in the pharmaceutical industry for the synthesis of certain biologically active compounds. It is also utilized in the polymer industry as a monomer for the development of new materials. Additionally, it has applications in sensor technology and semiconductor manufacturing due to its unique chemical properties.

What precautions should be taken when handling trans-4-Phenyl-L-proline hydrochloride (CAS: 90657-53-7)?

When handling trans-4-Phenyl-L-proline hydrochloride, it is important to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area or a fume hood. In case of a spill, it should be carefully cleaned up with appropriate materials and flushed with water. Always refer to the safety data sheet (SDS) for detailed handling instructions and emergency procedures.