86978-24-7

Name (Z)-2-(2-tert-Butoxycarbonylaminothiazol-4-yl)-2-pentenoic acid
CAS 86978-24-7
EINECS(EC#) 430-100-3
Molecular Formula C13H18N2O4S
MDL Number MFCD00062759
Molecular Weight 298.36
MOL File 86978-24-7.mol
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Chemical Properties

Melting point  159-161°C
density  1.279±0.06 g/cm3(Predicted)
storage temp.  Sealed in dry,2-8°C
solubility  Chloroform, Iso-propanol
form  Solid
pka 3.34±0.36(Predicted)
color  White to Off-White
InChI InChI=1S/C13H18N2O4S/c1-5-6-8(10(16)17)9-7-20-11(14-9)15-12(18)19-13(2,3)4/h6-7H,5H2,1-4H3,(H,16,17)(H,14,15,18)/b8-6-
InChIKey XIXNSLABECPEMI-VURMDHGXSA-N
SMILES C1(=CSC(NC(=O)OC(C)(C)C)=N1)/C(=C/CC)/C(O)=O
CAS DataBase Reference 86978-24-7(CAS DataBase Reference)

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302
Precautionary statements  P264-P270-P301+P312-P330-P501
REACH Registrations Active

Hazard Information

Spectrum Detail

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