Identification Chemical Properties Safety Data Hazard Information Supplier Related Products

136285-67-1

Name 2-[[(2'-Cyano[1,1'-biphenyl]-4-yl)methyl]amino]-3-nitro-benzoic acid ethyl ester
CAS 136285-67-1
EINECS(EC#) 603-952-0
Molecular Formula C23H19N3O4
MDL Number MFCD09030634
Molecular Weight 401.41
MOL File 136285-67-1.mol

Chemical Properties

Melting point  >209°C (dec.)
Boiling point  602.9±55.0 °C(Predicted)
density  1.31
storage temp.  Refrigerator
solubility  DMSO (Slightly), Methanol (Slightly)
form  Solid
pka -2.57±0.10(Predicted)
color  Yellow
InChI InChI=1S/C23H19N3O4/c1-2-30-23(27)20-8-5-9-21(26(28)29)22(20)25-15-16-10-12-17(13-11-16)19-7-4-3-6-18(19)14-24/h3-13,25H,2,15H2,1H3
InChIKey CHPMKOFPDCKNBG-UHFFFAOYSA-N
SMILES C(OCC)(=O)C1=CC=CC([N+]([O-])=O)=C1NCC1=CC=C(C2=CC=CC=C2C#N)C=C1

Safety Data

HS Code  2916399090

Hazard Information

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