79561-82-3

Name (R)-N-BOC-4-Bromophenylalanine
CAS 79561-82-3
Molecular Formula C14H18BrNO4
MDL Number MFCD00270359
Molecular Weight 344.2
MOL File 79561-82-3.mol

Chemical Properties

Appearance off-white crystalline powder
Melting point  117.0 to 121.0 °C
Boiling point  475.3±40.0 °C(Predicted)
density  1.5311 (rough estimate)
refractive index  1.6500 (estimate)
storage temp.  Store at RT.
solubility  soluble in Methanol
form  powder to crystal
pka 3.83±0.10(Predicted)
color  White to Almost white
InChI InChI=1S/C14H18BrNO4/c1-14(2,3)20-13(19)16-11(12(17)18)8-9-4-6-10(15)7-5-9/h4-7,11H,8H2,1-3H3,(H,16,19)(H,17,18)/t11-/m1/s1
InChIKey ULNOXUAEIPUJMK-LLVKDONJSA-N
SMILES C(O)(=O)[C@@H](CC1=CC=C(Br)C=C1)NC(OC(C)(C)C)=O
CAS DataBase Reference 79561-82-3(CAS DataBase Reference)

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H315-H319-H302-H335
Precautionary statements  P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362
Hazard Codes  Xi
WGK Germany  3
HazardClass  IRRITANT
HS Code  2924297099

Hazard Information

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