486460-00-8

Name BOC-(R)-3-AMINO-4-(2,4,5-TRIFLUORO-PHENYL)-BUTYRIC ACID
CAS 486460-00-8
EINECS(EC#) 691-120-8
Molecular Formula C15H18F3NO4
MDL Number MFCD06659147
Molecular Weight 333.3
MOL File 486460-00-8.mol

Chemical Properties

Melting point  136-138℃
Boiling point  443.1±45.0 °C(Predicted)
density  1.292±0.06 g/cm3(Predicted)
storage temp.  Sealed in dry,2-8°C
solubility  Chloroform (Slightly), DMSO (Slightly), Ethyl Acetate (Slightly), Methanol (Slightly)
form  Solid
pka 4.30±0.10(Predicted)
color  White to Off-White
Optical Rotation 25.305°(C=0.01g/ mI, CHCL3 , 20°C, 589nm)
InChI InChI=1/C15H18F3NO4/c1-15(2,3)23-14(22)19-9(6-13(20)21)4-8-5-11(17)12(18)7-10(8)16/h5,7,9H,4,6H2,1-3H3,(H,19,22)(H,20,21)/t9-/s3
InChIKey TUAXCHGULMWHIO-DJEYLCQNNA-N
SMILES C(C1C=C(F)C(F)=CC=1F)[C@H](CC(=O)O)NC(=O)OC(C)(C)C |&1:10,r|

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H319
Precautionary statements  P305+P351+P338
REACH Registrations Active
HazardClass  IRRITANT

Hazard Information

Questions And Answer

Supplier