ChemicalBook--->CAS DataBase List--->7652-46-2

7652-46-2

7652-46-2 Structure

7652-46-2 Structure
IdentificationBack Directory
[Name]

N-ACETYL-L-CYSTEINE METHYL ESTER
[CAS]

7652-46-2
[Synonyms]

Ac-Cys-Ome
AC-L-CYS-OME
(AC-CYS-OME)2
N-Acetyl-L-cysteine(OMe)
Methyl acetyl-L-cysteinate
Methyl N-acetyl-L-cysteinate
ACETYL-L-CYSTINE DIMETHYL ESTER
N-ACETYL-L-CYSTEINE METHYL ESTER
L-Cysteine,N-acetyl-,methyl ester
methyl (2R)-2-acetamido-3-sulfanylpropanoate
N-Acetyl-L-cysteine methyl ester >=90% (HPLC)
[Molecular Formula]

C6H11NO3S
[MDL Number]

MFCD00237476
[MOL File]

7652-46-2.mol
[Molecular Weight]

177.22
Chemical PropertiesBack Directory
[Melting point ]

77-81 °C
[Boiling point ]

326.4±32.0 °C(Predicted)
[density ]

1.170±0.06 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,2-8°C
[solubility ]

Chloroform (Sparingly), Methanol (Slightly)
[form ]

Solid
[pka]

9.13±0.10(Predicted)
[color ]

White to Off-White
[Optical Rotation]

[α]20/D 24.0±3°, c = 1% in methanol
[BRN ]

1724357
[InChI]

InChI=1S/C6H11NO3S/c1-4(8)7-5(3-11)6(9)10-2/h5,11H,3H2,1-2H3,(H,7,8)/t5-/m0/s1
[InChIKey]

QTKAQJWFVXPIFV-YFKPBYRVSA-N
[SMILES]

C(OC)(=O)[C@H](CS)NC(C)=O
Safety DataBack Directory
[Safety Statements ]

22-24/25
[WGK Germany ]

3
[F ]

10-23
Hazard InformationBack Directory
[Uses]

N-Acetyl-L-cysteine Methyl Ester is used in the preparation of benzyl mono-fluorophosphonate and benzyl penta-fluorophosphate anions as physiologically stable phosphotyrosine mimetics and inhibitors of protein tyrosine phosphatases. It can also be used in the preparation of anthracene derivatives.
[reaction suitability]

reaction type: solution phase peptide synthesis
Spectrum DetailBack Directory
[Spectrum Detail]

N-ACETYL-L-CYSTEINE METHYL ESTER(7652-46-2)1HNMR
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