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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

E 2012, MedChemExpress

MedChemExpress E 2012 is a potent gamma (γ) secretase modulator without affecting Notch processing. E 2012 inhibits 3β-hydroxysterol δ24-reductase (DHCR24) at the final step in the cholesterol biosynthesis. E 2012 aims at Alzheimer's disease by reduction of amyloid β-42, and induces cataract following repeated doses in the rat.

ENCOMPASS_PREFERRED
Molecular Weight (g/mol) 419.49
Color Light Yellow
Physical Form Solid
Chemical Name or Material E 2012
Grade Research
SMILES O=C(N([C@H](C1=CC=C(C=C1)F)C)CCC/2)C2=C\C3=CC=C(N4C=NC(C)=C4)C(OC)=C3
For Use With (Application) Neuroscience-Neurodegeneration
Percent Purity 97.39%
CAS 870843-42-8
Solubility Information DMSO : ≥ 50 mg/mL (119.19 mM)
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 C25H26FN3O2
Formula Weight 419.49
2

E-7386, MedChemExpress

MedChemExpress E-7386 is an orally active CBP/beta-catenin modulator.

ENCOMPASS ENCOMPASS_PREFERRED
Molecular Weight (g/mol) 725.85
Color Off-White
Physical Form Solid
Chemical Name or Material E-7386
Grade Research
SMILES O=C(N([C@](CN1CC2=NC(N3CC(N4CCN(CC)CC4)C3)=CC=C2)([H])N5[C@@H](CC6=CC=C(O)C=C6F)C1=O)N(CC=C)CC5=O)NCC7=CC=CC=C7
For Use With (Application) Cancer-programmed cell death
Percent Purity 98.34%
CAS 1799824-08-0
Solubility Information DMSO : 125 mg/mL (172.21 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 C39H48FN9O4
Formula Weight 725.85
3

2-Chloro-6-fluorobenzaldoxime, 97%

CAS: 443-33-4 Molecular Formula: C7H5ClFNO Molecular Weight (g/mol): 173.57 MDL Number: MFCD00837704 InChI Key: OBJHLLOVMKKXDI-ONNFQVAWSA-N Synonym: 2-chloro-6-fluorobenzaldehyde oxime,2-chloro-6-fluorobenzaldoxime,6-chloro-2-fluorophenyl hydroxyimino methane,pubchem2883,e-n-2-chloro-6-fluorophenyl methylidene hydroxylamine,1e-2-chloro-6-fluorobenzaldehyde oxime,e-1-2-chloro-6-fluorophenyl-n-hydroxymethanimine,ne-n-2-chloro-6-fluorophenyl methylidene hydroxylamine,ne-n-2-chloranyl-6-fluoranyl-phenyl methylidene hydroxylamine PubChem CID: 7329318 SMILES: O\N=C\C1=C(F)C=CC=C1Cl

PubChem CID 7329318
CAS 443-33-4
Molecular Weight (g/mol) 173.57
MDL Number MFCD00837704
SMILES O\N=C\C1=C(F)C=CC=C1Cl
Synonym 2-chloro-6-fluorobenzaldehyde oxime,2-chloro-6-fluorobenzaldoxime,6-chloro-2-fluorophenyl hydroxyimino methane,pubchem2883,e-n-2-chloro-6-fluorophenyl methylidene hydroxylamine,1e-2-chloro-6-fluorobenzaldehyde oxime,e-1-2-chloro-6-fluorophenyl-n-hydroxymethanimine,ne-n-2-chloro-6-fluorophenyl methylidene hydroxylamine,ne-n-2-chloranyl-6-fluoranyl-phenyl methylidene hydroxylamine
InChI Key OBJHLLOVMKKXDI-ONNFQVAWSA-N
Molecular Formula C7H5ClFNO
4

2-chloro-6-fluorophenylboronic acid, 97%, Thermo Scientific™

CAS: 313545-32-3 Molecular Formula: C6H5BClFO2 Molecular Weight (g/mol): 174.36 MDL Number: MFCD04039892 InChI Key: NXSZSZJWZVLHAY-UHFFFAOYSA-N Synonym: 2-chloro-6-fluorophenyl boronic acid,2-chloro-6-fluorobenzeneboronic acid,2-chloro-6-fluorophenylboronicacid,boronic acid, 2-chloro-6-fluorophenyl,boronic acid,b-2-chloro-6-fluorophenyl,boronic acid, b-2-chloro-6-fluorophenyl,pubchem18883,acmc-1ad0v,2-borono-1-chloro-3-fluorobenzene,2-chloro-6-fluorobenzene boronic acid PubChem CID: 3549395 IUPAC Name: (2-chloro-6-fluorophenyl)boronic acid SMILES: OB(O)C1=C(F)C=CC=C1Cl

PubChem CID 3549395
CAS 313545-32-3
Molecular Weight (g/mol) 174.36
MDL Number MFCD04039892
SMILES OB(O)C1=C(F)C=CC=C1Cl
Synonym 2-chloro-6-fluorophenyl boronic acid,2-chloro-6-fluorobenzeneboronic acid,2-chloro-6-fluorophenylboronicacid,boronic acid, 2-chloro-6-fluorophenyl,boronic acid,b-2-chloro-6-fluorophenyl,boronic acid, b-2-chloro-6-fluorophenyl,pubchem18883,acmc-1ad0v,2-borono-1-chloro-3-fluorobenzene,2-chloro-6-fluorobenzene boronic acid
IUPAC Name (2-chloro-6-fluorophenyl)boronic acid
InChI Key NXSZSZJWZVLHAY-UHFFFAOYSA-N
Molecular Formula C6H5BClFO2
5

Rufinamide, MedChemExpress

MedChemExpress Rufinamide(E 2080; CGP 33101; RUF 331) is a new antiepileptic agent that differs structurally from other antiepileptic drugs and is approved as adjunctive therapy for Lennox-Gastaut syndrome (LGS).

ENCOMPASS_PREFERRED
Molecular Weight (g/mol) 238.19
Color White
Physical Form Solid
Chemical Name or Material Rufinamide
Grade Research
SMILES O=C(C1=CN(CC2=C(F)C=CC=C2F)N=N1)N
For Use With (Application) Neuroscience-Neurodegeneration
Percent Purity 99.88%
CAS 106308-44-5
Solubility Information DMSO : 50 mg/mL (209.92 mM; Need ultrasonic)
Synonym CGP 33101 E 2080 RUF 331
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 C10H8F2N4O
Formula Weight 238.19
6

Golvatinib, MedChemExpress

MedChemExpress Golvatinib (E-7050) is a potent dual inhibitor of both c-Met and VEGFR2 kinases with IC50s of 14 and 16 nM, respectively.

ENCOMPASS_PREFERRED
Molecular Weight (g/mol) 633.69
Color White
Physical Form Powder
Chemical Name or Material Golvatinib
Grade Research
SMILES O=C(NC1=CC=C(C=C1F)OC2=CC(NC(N3CCC(CC3)N4CCN(CC4)C)=O)=NC=C2)C5(CC5)C(NC6=CC=C(C=C6)F)=O
For Use With (Application) Cancer-Kinase/protease
Percent Purity 99.15%
CAS 928037-13-2
Solubility Information DMSO : 50 mg/mL (78.90 mM; Need ultrasonic)
Synonym E-7050
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 C33H37F2N7O4
Formula Weight 633.69
7

3,4-Difluorobenzamidoxime, 97%, Thermo Scientific™

CAS: 500024-74-8 Molecular Formula: C7H6F2N2O Molecular Weight (g/mol): 172.14 MDL Number: MFCD06660194,MFCD06796653 InChI Key: OGCLGUHODKKLSH-UHFFFAOYSA-N Synonym: 3,4-difluorobenzamidoxime,3,4-difluoro-n-hydroxy-benzamidine,3,4-difluoro-n'-hydroxybenzene-1-carboximidamide,3,4-difluorophenyl hydroxyimino methylamine,benzenecarboximidamide, 3,4-difluoro-n-hydroxy,z-3,4-difluoro-n'-hydroxybenzene-1-carboximidamide,e-3,4-difluoro-n'-hydroxybenzenecarboximidamide PubChem CID: 17750753 IUPAC Name: 3,4-difluoro-N'-hydroxybenzenecarboximidamide SMILES: NC(=NO)C1=CC(F)=C(F)C=C1

PubChem CID 17750753
CAS 500024-74-8
Molecular Weight (g/mol) 172.14
MDL Number MFCD06660194,MFCD06796653
SMILES NC(=NO)C1=CC(F)=C(F)C=C1
Synonym 3,4-difluorobenzamidoxime,3,4-difluoro-n-hydroxy-benzamidine,3,4-difluoro-n'-hydroxybenzene-1-carboximidamide,3,4-difluorophenyl hydroxyimino methylamine,benzenecarboximidamide, 3,4-difluoro-n-hydroxy,z-3,4-difluoro-n'-hydroxybenzene-1-carboximidamide,e-3,4-difluoro-n'-hydroxybenzenecarboximidamide
IUPAC Name 3,4-difluoro-N'-hydroxybenzenecarboximidamide
InChI Key OGCLGUHODKKLSH-UHFFFAOYSA-N
Molecular Formula C7H6F2N2O
8

Lemborexant, MedChemExpress

MedChemExpress Lemborexant (E-2006) is a reversible, competitive and orally active dual antagonist of the orexin OX1 and OX2 receptors with IC50 values of 6.1 nM and 2.6 nM, respectively. Lemborexant can be treated insomnia.

ENCOMPASS
Molecular Weight (g/mol) 410.42
Color White
Physical Form Powder
Chemical Name or Material Lemborexant
Grade Research
SMILES O=C([C@H]1[C@@](C2=CC=CC(F)=C2)(COC3=CN=C(C)N=C3C)C1)NC4=NC=C(F)C=C4
Percent Purity 99.19%
CAS 1369764-02-2
Solubility Information DMSO : 100 mg/mL (243.65 mM; Need ultrasonic)
Synonym E-2006
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 C22H20F2N4O2
Formula Weight 410.42