223537-30-2

Name ethyl (E,4S)-4-[[(2R,5S)-2-[(4-fluorophenyl)methyl]-6-methyl-5-[(5-met hyloxazole-3-carbonyl)amino]-4-oxo-heptanoyl]amino]-5-[(3S)-2-oxopyrro lidin-3-yl]pent-2-enoate
CAS 223537-30-2
Molecular Formula C31H39FN4O7
MDL Number MFCD13185163
Molecular Weight 598.66
MOL File 223537-30-2.mol

Chemical Properties

Melting point  170-171°C
Boiling point  866.7±65.0 °C(Predicted)
density  1.213
storage temp.  room temp
solubility  Chloroform (Slightly), Methanol (Slightly)
form  powder
pka 12.16±0.46(Predicted)
color  white to beige
Optical Rotation [α]/D +30 to +40°, c = 0.5 in chloroform-d
InChIKey CAYJBRBGZBCZKO-BHGBQCOSSA-N
SMILES C(OCC)(=O)/C=C/[C@@H](NC(=O)[C@H](CC1=CC=C(F)C=C1)CC(=O)[C@@H](NC(C1C=C(C)ON=1)=O)C(C)C)C[C@@H]1CCNC1=O

Safety Data

WGK Germany  WGK 3
Storage Class 11 - Combustible Solids

Hazard Information

Supplier