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82278-73-7

Name (S)-N-Boc-3-Bromophenylalanine
CAS 82278-73-7
EINECS(EC#) 1592732-453-0
Molecular Formula C14H18BrNO4
MDL Number MFCD01317710
Molecular Weight 344.2
MOL File 82278-73-7.mol

Chemical Properties

Appearance off-white powder
Melting point  106.1°C
Boiling point  475.3±40.0 °C(Predicted)
density  1.5311 (rough estimate)
refractive index  1.6500 (estimate)
storage temp.  Store at 0°C
form  Solid
pka 3.81±0.10(Predicted)
color  White to off-white
Optical Rotation Consistent with structure
Water Solubility  Slightly soluble in water.
InChI InChI=1S/C14H18BrNO4/c1-14(2,3)20-13(19)16-11(12(17)18)8-9-5-4-6-10(15)7-9/h4-7,11H,8H2,1-3H3,(H,16,19)(H,17,18)/t11-/m0/s1
InChIKey FBUDYESOPLBQIR-NSHDSACASA-N
SMILES C(O)(=O)[C@H](CC1=CC=CC(Br)=C1)NC(OC(C)(C)C)=O
CAS DataBase Reference 82278-73-7(CAS DataBase Reference)

Safety Data

HazardClass  IRRITANT
HS Code  2922498590

Hazard Information

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