115065-79-7

Name 2-[2-[[(Phenylmethoxy)carbonyl]amino]-4-thiazolyl]-2-pentenedioic acid 5-(3-methyl-2-butenyl) ester
CAS 115065-79-7
EINECS(EC#) 601-343-4
Molecular Formula C21H22N2O6S
MDL Number MFCD09750993
Molecular Weight 430.47
MOL File 115065-79-7.mol
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Chemical Properties

density  1.329
storage temp.  2-8°C
pka 2.90±0.19(Predicted)
InChI InChI=1S/C21H22N2O6S/c1-14(2)10-11-28-18(24)9-8-16(19(25)26)17-13-30-20(22-17)23-21(27)29-12-15-6-4-3-5-7-15/h3-8,10,13H,9,11-12H2,1-2H3,(H,25,26)(H,22,23,27)
InChIKey QSJNRPJXKFDFPH-UHFFFAOYSA-N
SMILES C(O)(=O)C(C1=CSC(NC(OCC2=CC=CC=C2)=O)=N1)=CCC(OC/C=C(\C)/C)=O
CAS DataBase Reference 115065-79-7(CAS DataBase Reference)

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H319-H315-H335-H302
Precautionary statements  P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362

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