13433-09-5

Name H-ASP-PHE-OH
CAS 13433-09-5
EINECS(EC#) 236-557-3
Molecular Formula C13H16N2O5
MDL Number MFCD00063155
Molecular Weight 280.28
MOL File 13433-09-5.mol
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Chemical Properties

Appearance white powder
Melting point  236-239 °C(lit.)
Boiling point  423°C (rough estimate)
density  1.2419 (rough estimate)
refractive index  1.6450 (estimate)
storage temp.  −20°C
solubility  DMSO:5.0(Max Conc. mg/mL);17.84(Max Conc. mM)
DMSO:PBS (pH 7.2) (1:2):0.3(Max Conc. mg/mL);1.07(Max Conc. mM)
form  Powder
pka 3.35±0.10(Predicted)
color  Off-white to yellow to beige to orange to tan
Optical Rotation [α]20/D +12.5°, c = 1 in 0.5 M HCl
BRN  2817528
Major Application peptide synthesis
InChI InChI=1/C13H16N2O5/c14-9(7-11(16)17)12(18)15-10(13(19)20)6-8-4-2-1-3-5-8/h1-5,9-10H,6-7,14H2,(H,15,18)(H,16,17)(H,19,20)/t9-,10-/s3
InChIKey YZQCXOFQZKCETR-DPIMBTEZNA-N
SMILES C1(=CC=CC=C1)C[C@@H](C(=O)O)NC(=O)[C@@H](N)CC(=O)O |&1:7,14,r|

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H315-H319-H335
Precautionary statements  P261-P271-P280
Safety Statements 
WGK Germany  3
HS Code  29242990
Storage Class 11 - Combustible Solids

Hazard Information

Spectrum Detail

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