72679-02-8

Name (S)-(-)-3-(Benzoylthio)-2-methylpropanoic acid
CAS 72679-02-8
EINECS(EC#) 276-764-6
Molecular Formula C11H12O3S
MDL Number MFCD00038376
Molecular Weight 224.28
MOL File 72679-02-8.mol
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Chemical Properties

Melting point  61-63°C
Boiling point  367.5±34.0 °C(Predicted)
density  1.249±0.06 g/cm3(Predicted)
storage temp.  Refrigerator, Under Inert Atmosphere
solubility  Chloroform, Ethanol, Methanol
form  Solid
pka 4.20±0.10(Predicted)
color  White to Off-White
InChI InChI=1S/C11H12O3S/c1-8(10(12)13)7-15-11(14)9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,12,13)/t8-/m1/s1
InChIKey BCAYPPFBOJCRPN-MRVPVSSYSA-N
SMILES C(O)(=O)[C@H](C)CSC(=O)C1=CC=CC=C1

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P305+P351+P338
HS Code  2930.90.2900
REACH Registrations Active

Hazard Information

Spectrum Detail

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