2-Methyl-2-propanyl phenylalaninate hydrochloride (1:1)

Basic Information

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CAS Number

15100-75-1

Molecular Formula

C13H20ClNO2

Molecular Weight

257.76 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

Basic Chemical Raw Materials Organic Chemicals Amines

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

249-252°C

Boiling Point

303.3 ºC at 760 mmHg

Flash Point

158.2ºC

Specific Rotation

+47.0±1°, (c = 2% in ethanol)

SMILES

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CC(C)(C)OC(=O)C(CC1=CC=CC=C1)N.Cl

InChI

InChI=1S/C13H19NO2.ClH/c1-13(2,3)16-12(15)11(14)9-10-7-5-4-6-8-10;/h4-8,11H,9,14H2,1-3H3;1H/t11-;/m0./s1

InChIKey

FDMCEXDXULPJPG-MERQFXBCSA-N

LogP

2.3199000000000005

Topological Polar Surface Area

52.32 Å²

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

227

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

Sensitiveness

Prone to absorbing moisture

Synonyms & References

English

AKOS015888340
DS-2285
J-019431
phenylalanine t-butyl ester hydrochloride
phenylalanine tert butyl ester hydrochloride
L-Phenylalanine tert-butyl ester hydrochloride, >=99.0% (HPLC)
SCHEMBL237074
H-Phe-OtBu hydrochloride
EN300-108902
(L)-phenylalanine t-butyl ester hydrochloride
(S)-2-amino-3-phenyl-propionic acid tert-butyl ester hydrochloride
L-Phenylalanine, 1,1-dimethylethyl ester, hydrochloride (1:1)
CHEMBL1222003
tert-butyl (2S)-2-amino-3-phenylpropanoate;hydrochloride
L-phenylalanine, tert-butyl ester hydrochloride
L-Phe-O-t-Bu hydrochloride
J-300217
L-Phenylalanine tert-butyl ester hydrochloride
HY-W011830
AKOS015924113
W-108067
[(2S)-1-[(2-methylpropan-2-yl)oxy]-1-oxo-3-phenylpropan-2-yl]azanium;chloride
15100-75-1
phenylalanine tert-butyl ester hydrochloride
CS-W012546
L-PHENYLALANINE TERT-BUTYL ESTER HCL
(l)-phenylalanine t-butyl ester hydrochloride salt
FDMCEXDXULPJPG-MERQFXBCSA-N
MFCD00038894
L-Phenylalanine t-Butyl Ester Hydrochloride
(S)-tert-Butyl 2-amino-3-phenylpropanoate hydrochloride

MDL Number

MFCD00038894

Customs Code

2922499990

FAQ

What is 2-Methyl-2-propanyl phenylalaninate hydrochloride (CAS: 15100-75-1)?

2-Methyl-2-propanyl phenylalaninate hydrochloride (CAS: 15100-75-1) is an organic compound used in pharmaceutical and chemical industries. It is a salt formed by the combination of 2-methyl-2-propanyl phenylalaninate with hydrochloric acid in a 1:1 molar ratio.

What are the main uses of 2-Methyl-2-propanyl phenylalaninate hydrochloride (CAS: 15100-75-1)?

2-Methyl-2-propanyl phenylalaninate hydrochloride is primarily used as a pharmaceutical intermediate and in the synthesis of various organic compounds. It is also utilized in research for developing new chemical entities and in the modification of natural products.

Is 2-Methyl-2-propanyl phenylalaninate hydrochloride (CAS: 15100-75-1) safe?

2-Methyl-2-propanyl phenylalaninate hydrochloride (CAS: 15100-75-1) is generally safe when handled with appropriate precautions. Users should avoid contact with skin and eyes, and ensure proper ventilation. It is important to follow safety guidelines and wear protective clothing during use.

How should 2-Methyl-2-propanyl phenylalaninate hydrochloride (CAS: 15100-75-1) be stored?

2-Methyl-2-propanyl phenylalaninate hydrochloride (CAS: 15100-75-1) should be stored in a cool, dry place away from direct sunlight and heat sources. Store it in a tightly closed container to prevent moisture and contamination. Avoid storing it with incompatible chemicals.