Formula | C14H9F6NO3 |
MW | 353.23 |
bulk_in | / |
comment | nan |
inchikey | RLHQJHDRAOFAOG-UHFFFAOYSA-N |
literature | UNKNOWN |
location | FKKT-HLAD_1 |
mass | 74,0 |
nmr_code | OK23091 |
rack_code | NU00246861 |
rack_number | 1 |
rack_position | 1B1 |
reasearcher | A._IVANCIC |
research_group | SVETE |
sample_state | TRUE_SAMPLE |
smiles | CCOC1=C(NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C(=O)C1=O |
vial_code | NUJD034459 |
vial_size | 1_mL |
mw | 353.2166 |
alogp | 4.4071 |
hba | 3 |
hbd | 1 |
rb | 6 |
heavyatomcount | 24 |
chiralcentercount | 0 |
chiralcentercountallpossible | 0 |
ringcount | 2 |
psa | 55.4 |
estate | 91.669 |
mr | 71.095 |
polar | 31.202 |
canvasuid | 13 |