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Home > Encyclopedia > N,S-Diacetyl-L-cysteine methyl ester

N,S-Diacetyl-L-cysteine methyl ester

N,S-Diacetyl-L-cysteine methyl ester structure

N,S-Diacetyl-L-cysteine methyl ester 

structure
  • CAS No:

    19547-88-7

  • Formula:

    C8H13NO4S

  • Chemical Name:

    N,S-Diacetyl-L-cysteine methyl ester

  • Synonyms:

    L-Cysteine,N,S-diacetyl-,methyl ester;Cysteine,N-acetyl-,methyl ester,acetate (ester),L-;L-Cysteine,N-acetyl-,methyl ester,acetate (ester);Acetic acid,thio-,S-ester with N-acetyl-L-cysteine methyl ester;N,S-Diacetyl-L-cysteine methyl ester;Mucothiol;N,S-Diacetylcysteine methyl ester

N,S-Diacetyl-L-cysteine methyl ester Basic Attributes

219.26

219.26

243-146-2

37X3OTM55N

Characteristics

97.8 Ų

1.208±0.06 g/cm3

100 °C @ Solvent: Ethyl acetate

379.4±32.0 °C(Predicted)

14.09±0.46

Safety Information

3

20/21/22-36/37/38

26-36-37/39

Xn,Xi

|Warning|H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]|P264, P280, P305+P351+P338, and P337+P313|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory.

Drug Information

N,S-diacetylcysteine methyl ester

Computed Properties

Molecular Weight:219.26
XLogP3:-0.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:219.05652907
Monoisotopic Mass:219.05652907
Topological Polar Surface Area:97.8
Heavy Atom Count:14
Complexity:242
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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