15537-71-0

Name N-ACETYL-3-MERCAPTO-D-VALINE
CAS 15537-71-0
EINECS(EC#) 239-585-4
Molecular Formula C7H13NO3S
MDL Number MFCD00078887
Molecular Weight 191.25
MOL File 15537-71-0.mol

Chemical Properties

Melting point  185-190 °C (dec.)
Boiling point  392.7±37.0 °C(Predicted)
density  1.201±0.06 g/cm3(Predicted)
storage temp.  Inert atmosphere,Room Temperature
solubility  Ethanol (Slightly), Methanol (Slightly), Trifluoroacetic Acid (Slightly)
form  Solid
pka 3.39±0.10(Predicted)
color  White to Off-White
Optical Rotation [α]20/D +10±2°, c = 1% in ethanol
Merck  13,100
BRN  1724742
Major Application peptide synthesis
InChI 1S/C7H13NO3S/c1-4(9)8-5(6(10)11)7(2,3)12/h5,12H,1-3H3,(H,8,9)(H,10,11)/t5-/m0/s1
InChIKey MNNBCKASUFBXCO-YFKPBYRVSA-N
SMILES CC(=O)N[C@@H](C(O)=O)C(C)(C)S || CC(=O)N[C@@H](C(O)=O)C(C)(C)S

Safety Data

Hazard Codes  Xi
Risk Statements 
Safety Statements 
WGK Germany  3
10-23
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3

Hazard Information

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