155723-02-7

Name (6R,7R)
CAS 155723-02-7
EINECS(EC#) 1308068-626-2
Molecular Formula C13H13N3O3S2
MDL Number MFCD12407319
Molecular Weight 323.39
MOL File 155723-02-7.mol

Chemical Properties

Boiling point  642.1±55.0 °C(Predicted)
density  1.59
solubility  DMSO, Water
pka 2.36±0.50(Predicted)
InChI InChI=1S/C13H13N3O3S2/c1-6-8(21-5-15-6)3-2-7-4-20-12-9(14)11(17)16(12)10(7)13(18)19/h2-3,5,9,12H,4,14H2,1H3,(H,18,19)/b3-2-/t9-,12-/m1/s1
InChIKey SDEIKNWRVHSKQN-FSZPXCJPSA-N
SMILES N12[C@@]([H])([C@H](N)C1=O)SCC(/C=C\C1SC=NC=1C)=C2C(O)=O

Safety Data

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

Hazard Information

Supplier