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Fluorobenzenes

Organic compounds considered aryl halides that consist of a phenyl group with a fluorine atom substitution in the following structure: C₆H₅F.

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1

Pentafluoroaniline, 97%

CAS: 771-60-8 Molecular Formula: C6H2F5N Molecular Weight (g/mol): 183.08 MDL Number: MFCD00007643 InChI Key: NOXLGCOSAFGMDV-UHFFFAOYSA-N Synonym: pentafluoroaniline,pentafluorophenylamine,aminopentafluorobenzene,benzenamine, 2,3,4,5,6-pentafluoro,2,3,4,5,6-pentafluorobenzenamine,aniline, 2,3,4,5,6-pentafluoro,unii-ms06il3y2q,ms06il3y2q,2,3,4,5,6-pentafluorophenylamine,pubchem1546 PubChem CID: 13040 SMILES: NC1=C(F)C(F)=C(F)C(F)=C1F

PubChem CID 13040
CAS 771-60-8
Molecular Weight (g/mol) 183.08
MDL Number MFCD00007643
SMILES NC1=C(F)C(F)=C(F)C(F)=C1F
Synonym pentafluoroaniline,pentafluorophenylamine,aminopentafluorobenzene,benzenamine, 2,3,4,5,6-pentafluoro,2,3,4,5,6-pentafluorobenzenamine,aniline, 2,3,4,5,6-pentafluoro,unii-ms06il3y2q,ms06il3y2q,2,3,4,5,6-pentafluorophenylamine,pubchem1546
InChI Key NOXLGCOSAFGMDV-UHFFFAOYSA-N
Molecular Formula C6H2F5N
2

2-Fluorobenzonitrile, 99%

CAS: 394-47-8 Molecular Formula: C7H4FN Molecular Weight (g/mol): 121.11 MDL Number: MFCD00001773 InChI Key: GDHXJNRAJRCGMX-UHFFFAOYSA-N Synonym: o-fluorobenzonitrile,benzonitrile, 2-fluoro,o-cyanofluorobenzene,2-fluorobenzonitril,2-cyanofluorobenzene,benzonitrile, o-fluoro,fluorobenzonitrile,2-fluorobenzenecarbonitrile,2-fluoro-benzonitrile,1-cyano-2-fluorobenzene PubChem CID: 67855 IUPAC Name: 2-fluorobenzonitrile SMILES: FC1=CC=CC=C1C#N

PubChem CID 67855
CAS 394-47-8
Molecular Weight (g/mol) 121.11
MDL Number MFCD00001773
SMILES FC1=CC=CC=C1C#N
Synonym o-fluorobenzonitrile,benzonitrile, 2-fluoro,o-cyanofluorobenzene,2-fluorobenzonitril,2-cyanofluorobenzene,benzonitrile, o-fluoro,fluorobenzonitrile,2-fluorobenzenecarbonitrile,2-fluoro-benzonitrile,1-cyano-2-fluorobenzene
IUPAC Name 2-fluorobenzonitrile
InChI Key GDHXJNRAJRCGMX-UHFFFAOYSA-N
Molecular Formula C7H4FN
3

1-Bromo-2,4-difluorobenzene, 98+%

CAS: 348-57-2 Molecular Formula: C6H3BrF2 Molecular Weight (g/mol): 192.99 MDL Number: MFCD00000330 InChI Key: MGHBDQZXPCTTIH-UHFFFAOYSA-N Synonym: 2,4-difluorobromobenzene,benzene, 1-bromo-2,4-difluoro,1-bromo-2,4-difluoro-benzene,bromo-2,4-difluorobenzene,2,4-difluoro-1-bromobenzene,attercop-chm at130629,fr cf de,pubchem2301,2.4-difluorobromobenzene,acmc-1adm3 PubChem CID: 67674 IUPAC Name: 1-bromo-2,4-difluorobenzene SMILES: FC1=CC=C(Br)C(F)=C1

PubChem CID 67674
CAS 348-57-2
Molecular Weight (g/mol) 192.99
MDL Number MFCD00000330
SMILES FC1=CC=C(Br)C(F)=C1
Synonym 2,4-difluorobromobenzene,benzene, 1-bromo-2,4-difluoro,1-bromo-2,4-difluoro-benzene,bromo-2,4-difluorobenzene,2,4-difluoro-1-bromobenzene,attercop-chm at130629,fr cf de,pubchem2301,2.4-difluorobromobenzene,acmc-1adm3
IUPAC Name 1-bromo-2,4-difluorobenzene
InChI Key MGHBDQZXPCTTIH-UHFFFAOYSA-N
Molecular Formula C6H3BrF2
4

3-Bromofluorobenzene, 99%

CAS: 1073-06-9 Molecular Formula: C6H4BrF Molecular Weight (g/mol): 175 MDL Number: MFCD00000326 InChI Key: QDFKKJYEIFBEFC-UHFFFAOYSA-N Synonym: 3-bromofluorobenzene,m-bromofluorobenzene,m-fluorobromobenzene,benzene, 1-bromo-3-fluoro,3-bromfluorbenzen,3-fluorobromobenzene,m-fluorophenyl bromide,1-fluoro-3-bromobenzene,3-fluoro bromobenzene,benzene, 1-fluoro-3-bromo PubChem CID: 14082 IUPAC Name: 1-bromo-3-fluorobenzene SMILES: C1=CC(=CC(=C1)Br)F

PubChem CID 14082
CAS 1073-06-9
Molecular Weight (g/mol) 175
MDL Number MFCD00000326
SMILES C1=CC(=CC(=C1)Br)F
Synonym 3-bromofluorobenzene,m-bromofluorobenzene,m-fluorobromobenzene,benzene, 1-bromo-3-fluoro,3-bromfluorbenzen,3-fluorobromobenzene,m-fluorophenyl bromide,1-fluoro-3-bromobenzene,3-fluoro bromobenzene,benzene, 1-fluoro-3-bromo
IUPAC Name 1-bromo-3-fluorobenzene
InChI Key QDFKKJYEIFBEFC-UHFFFAOYSA-N
Molecular Formula C6H4BrF
5

Vactosertib, MedChemExpress

MedChemExpress Vactosertib (EW-7197) is a potent, orally active and ATP-competitive activin receptor-like kinase 5 (ALK5) inhibitor with an IC50 of 12.9 nM. Vactosertib also inhibits ALK2 and ALK4 (IC50 of 17.3 nM) at nanomolar concentrations. Vactosertib has potently antimetastatic activity and anticancer effect.

ENCOMPASS_PREFERRED
Molecular Weight (g/mol) 399.42
Color Light Yellow
Physical Form Solid
Chemical Name or Material Vactosertib
Grade Research
SMILES CC1=CC=CC(C2=C(C3=CN4C(C=C3)=NC=N4)NC(CNC5=CC=CC=C5F)=N2)=N1
For Use With (Application) Cancer-Kinase/protease
Percent Purity 98.27%
CAS 1352608-82-2
Solubility Information DMSO : 100 mg/mL (250.36 mM; Need ultrasonic)
Synonym EW-7197 TEW-7197
Purity Grade Notes Research
Recommended Storage Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Shelf Life Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Molecular Formula C22H18FN7
Formula Weight 399.42
6

Risperidone, MedChemExpress

MedChemExpress Risperidone is a serotonin 5-HT2 receptor blocker, P-Glycoprotein inhibitor and potent dopamine D2 receptor antagonist, with Kis of 4.8, 5.9 nM for 5-HT2A and dopamine D2 receptor, respectively.

ENCOMPASS_PREFERRED
Molecular Weight (g/mol) 410.48
Color Off-White
Physical Form Solid
Chemical Name or Material Risperidone
Grade Research
SMILES O=C1C(CCN2CCC(C3=NOC4=C3C=CC(F)=C4)CC2)=C(C)N=C5N1CCCC5
For Use With (Application) Neuroscience-Neuromodulation
Percent Purity 98.01%
CAS 106266-06-2
Solubility Information DMSO : 10 mg/mL (24.36 mM; ultrasonic and warming and heat to 60°C)
Health Hazard 1 H301
Synonym R 64 766
Purity Grade Notes Research
Recommended Storage Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Shelf Life Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Molecular Formula C23H27FN4O2
Formula Weight 410.48
7

LY 344864 S-enantiomer, MedChemExpress

MedChemExpress LY 344864 S-enantiomer is the S-enantiomer of LY344864. LY344864 is a 5-HT1F receptor agonist.

ENCOMPASS_PREFERRED
Percent Purity 98.0%
CAS 186544-27-4
Molecular Weight (g/mol) 351.42
Color Light Yellow
Physical Form Solid
Chemical Name or Material LY 344864 S-enantiomer
Grade Research
SMILES O=C(NC1=CC2=C(NC3=C2C[C@@H](N(C)C)CC3)C=C1)C4=CC=C(F)C=C4
Purity Grade Notes Research
Recommended Storage Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Shelf Life Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Molecular Formula C21H22FN3O
Formula Weight 351.42
8

Emricasan, MedChemExpress

MedChemExpress Emricasan (PF 03491390) is an orally active and irreversible pan-caspase inhibitor. Emricasan inhibits Zika virus (ZIKV)-induced increases in caspase-3 activity and protected human cortical neural progenitors.

ENCOMPASS_PREFERRED
Molecular Weight (g/mol) 569.5
Color White
Physical Form Solid
Chemical Name or Material Emricasan
Grade Research
SMILES FC1=C(C(F)=C(C=C1F)F)OCC([C@@H](NC([C@@H](NC(C(NC2=C(C=CC=C2)C(C)(C)C)=O)=O)C)=O)CC(O)=O)=O
For Use With (Application) Cancer-programmed cell death
Percent Purity 98.04%
CAS 254750-02-2
Solubility Information DMSO : 100 mg/mL (175.59 mM; Need ultrasonic)
Health Hazard 1 H302∣H315∣H319∣H335
Synonym PF 03491390 IDN-6556
Purity Grade Notes Research
Recommended Storage Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Shelf Life Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Molecular Formula C26H27F4N3O7
Formula Weight 569.5
9

Pyridone 6, MedChemExpress

MedChemExpress Pyridone 6 is a pan-JAK inhibitor, which potently inhibits the JAK kinase family, with IC50s of 1 nM for JAK2 and TYK2, 5 nM for JAK3, and 15 nM for JAK1, while displaying significantly weaker affinities (130 nM to >10 mM) for other protein tyrosine kinases.

ENCOMPASS_PREFERRED
Molecular Weight (g/mol) 309.34
Color Brown
Physical Form Solid
Chemical Name or Material Pyridone 6
Grade Research
SMILES FC1=CC2=C(C(NC=C3)=O)C3=C(N=C(C(C)(C)C)N4)C4=C2C=C1
For Use With (Application) Cancer-Kinase/protease
Percent Purity 98.84%
CAS 457081-03-7
Solubility Information DMSO : ≥ 100 mg/mL (323.27 mM)
Health Hazard 1 H315∣H319∣H335
Purity Grade Notes Research
Recommended Storage Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Shelf Life Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Molecular Formula C18H16FN3O
Formula Weight 309.34
10

Rimacalib, MedChemExpress

MedChemExpress Rimacalib (SMP 114) is a Ca2+/calmodulin-dependent protein kinase II (CaMKII) inhibitor, with IC50s of ∼1 μM for CaMKIIα to ∼30 μM for CaMKIIγ.

ENCOMPASS_PREFERRED
Molecular Weight (g/mol) 394.44
Color Pink
Physical Form Solid
Chemical Name or Material Rimacalib
Grade Research
SMILES N=C(N1CCOCC1)NC2=CC([C@H](C3=CC=C(C4=CC=CC=C4)C(F)=C3)C)=NO2
For Use With (Application) Metabolism-protein/nucleotide metabolism
Percent Purity 99.65%
CAS 215174-50-8
Solubility Information DMSO : 125 mg/mL (316.90 mM; Need ultrasonic)
Synonym SMP 114
Purity Grade Notes Research
Recommended Storage Powder -20°C 3 years∣In solvent -80°C 6 months, -20°C 1 month
Shelf Life Powder -20°C 3 years∣In solvent -80°C 6 months, -20°C 1 month
Molecular Formula C22H23FN4O2
Formula Weight 394.44
11

Idasanutlin, MedChemExpress

MedChemExpress Idasanutlin (RG7388) is a potent and selective MDM2 antagonist, inhibiting p53-MDM2 binding, with an IC50 of 6 nM.

ENCOMPASS_PREFERRED
Molecular Weight (g/mol) 616.48
Color Off-White
Physical Form Solid
Chemical Name or Material Idasanutlin
Grade Research
SMILES O=C(O)C1=CC(OC)=C(NC([C@H]2[C@H](C3=C(F)C(Cl)=CC=C3)[C@](C4=CC=C(Cl)C=C4F)(C#N)[C@H](CC(C)(C)C)N2)=O)C=C1
For Use With (Application) Cancer-programmed cell death
Percent Purity 97.15%
CAS 1229705-06-9
Solubility Information DMSO : ≥ 45 mg/mL (73.00 mM)
Synonym RG7388
Purity Grade Notes Research
Recommended Storage Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Shelf Life Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Molecular Formula C31H29Cl2F2N3O4
Formula Weight 616.48
12

Talazoparib, MedChemExpress

MedChemExpress Talazoparib (BMN-673) is a highly potent, orally active PARP1/2 inhibitor.Talazoparib inhibits PARP1 and PARP2 enzyme activity with Kis of 1.2 nM and 0.87 nM, respectively. Talazoparib has antitumor activity.

ENCOMPASS_PREFERRED
Molecular Weight (g/mol) 380.35
Color White
Physical Form Solid
Chemical Name or Material Talazoparib
Grade Research
SMILES O=C1NN=C2C3=C1C=C(F)C=C3N[C@H](C4=CC=C(F)C=C4)[C@H]2C5=NC=NN5C
For Use With (Application) Cancer-programmed cell death
Percent Purity 98.97%
CAS 1207456-01-6
Solubility Information DMSO : 25 mg/mL (65.73 mM; Need ultrasonic)
Synonym BMN-673 LT-673
Purity Grade Notes Research
Recommended Storage Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Shelf Life Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Molecular Formula C19H14F2N6O
Formula Weight 380.35
13

AZD2906, MedChemExpress

MedChemExpress AZD2906 is a selective glucocorticoid receptor (GR) agonist, increases micronucleated immature erythrocytes in the bone marrow of rats. AZD2906 shows IC50s of 2.2, 0.3, 41.6 and 7.5 nM at GR in human, rat PBMC and human, rat whole blood, respectively.

ENCOMPASS_PREFERRED
Molecular Weight (g/mol) 460.5
Color Light Yellow
Physical Form Solid
Chemical Name or Material AZD2906
Grade Research
SMILES FC1=CC=C(N2N=CC3=CC(O[C@@H]([C@@H](NC(C4CC4)=O)C)C5=CC=C(N=C5)OC)=CC=C23)C=C1
For Use With (Application) Neuroscience-Neuromodulation
Percent Purity 99.82%
CAS 1034148-15-6
Solubility Information DMSO : 125 mg/mL (271.44 mM; Need ultrasonic)
Purity Grade Notes Research
Recommended Storage Powder -20°C 3 years∣In solvent -80°C 6 months, -20°C 1 month
Shelf Life Powder -20°C 3 years∣In solvent -80°C 6 months, -20°C 1 month
Molecular Formula C26H25FN4O3
Formula Weight 460.5
14

Medchem Express Q-VD-OPh, MedChemExpress

MedChemExpress Q-VD-OPh is an irreversible pan-caspase inhibitor with potent antiapoptotic properties; inhibits caspase 7 with an IC50 of 48 nM and 25-400 nM for other caspases including caspase 1, 3, 8, 9, 10, and 12. Q-VD-OPh can inhibits HIV infection. Q-VD-OPh is able to cross the blood-brain barrier.

ENCOMPASS_PREFERRED
Molecular Weight (g/mol) 513.49
Color White
Physical Form Powder
Chemical Name or Material Q-VD-OPh
Grade Research
SMILES O=C(O)C[C@H](NC([C@@H](NC(C1=NC2=CC=CC=C2C=C1)=O)C(C)C)=O)C(COC3=C(F)C=CC=C3F)=O
For Use With (Application) Cancer-programmed cell death
Percent Purity 98.04%
CAS 1135695-98-5
Solubility Information DMSO : 100 mg/mL (194.75 mM; Need ultrasonic)
Health Hazard 1 H302∣H315∣H319∣H335
Synonym QVD-OPH Quinoline-Val-Asp-Difluorophenoxymethylketone
Purity Grade Notes Research
Recommended Storage Powder -20°C 3 years∣In solvent -80°C 6 months, -20°C 1 month
Shelf Life Powder -20°C 3 years∣In solvent -80°C 6 months, -20°C 1 month
Molecular Formula C26H25F2N3O6
Formula Weight 513.49
15

CK-666, MedChemExpress

MedChemExpress CK-666 is a cell-permeable actin-related protein Arp2/3 complex inhibitor (IC50=12 μM). CK-666 binds to Arp2/3 complex, stabilizes the inactive state of the complex, blocking movement of the Arp2 and Arp3 subunits into the activated filament-like (short pitch) conformation.

ENCOMPASS_PREFERRED
Molecular Weight (g/mol) 296.34
Color White
Physical Form Solid
Chemical Name or Material CK-666
Grade Research
SMILES O=C(NCCC1=C(C)NC2=C1C=CC=C2)C3=CC=CC=C3F
Percent Purity 99.79%
CAS 442633-00-3
Solubility Information DMSO : 125 mg/mL (421.81 mM; Need ultrasonic)
Purity Grade Notes Research
Recommended Storage Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Shelf Life Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Molecular Formula C18H17FN2O
Formula Weight 296.34