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CHBO4

CAT: 0013-GTR19243614-01Size: 1 gDry Ice: NoHazardous: No
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CAT#:0013-GTR19243614-01Size:1 g
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Description
CHBO4 is a potent, reversible, competitive, and selective hMAO-B inhibitor with an IC50 value of 0.031 μM in CHBO subseries and an Ki value of 0.010 ± 0.005 μM. CHBO4 reduce cell damage by scavenging intracellular reactive oxygen species (ROS) . CHBO4 can be used for Parkinson's Disease (PD) research.
CAS Number
98991-32-3
Purity
>98% (HPLC)
Smiles
C (C=CC1=CC=C (F) C=C1) (=O) C2=CC=C (Br) C=C2
Molecular Formula
C15H10BrFO
Molecular Weight
305.14
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

2-Propen-1-one, 1-(4-bromophenyl)-3-(4-fluorophenyl)-
CAS Number98991-32-3
PubChem CID614578
IUPAC Name1-(4-bromophenyl)-3-(4-fluorophenyl)prop-2-en-1-one
Molecular FormulaC15H10BrFO
Molecular Weight305.14
XLogP3.9
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count18
Formal Charge0
Complexity300
SMILES
C1=CC(=CC=C1C=CC(=O)C2=CC=C(C=C2)Br)F
InChI
InChI=1S/C15H10BrFO/c16-13-6-4-12(5-7-13)15(18)10-3-11-1-8-14(17)9-2-11/h1-10H
InChIKey
JLKQXQSMJJGERH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Propen-1-one, 1-(4-bromophenyl)-3-(4-fluorophenyl)-
CAS: 98991-32-3
CID: 614578
Formula: C15H10BrFO
MW: 305.14
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight305.14
XLogP33.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass303.98991
Monoisotopic Mass303.98991
Topological Polar Surface Area17.1 Ų
Heavy Atom Count18
Formal Charge0
Complexity300
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count1
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
MBS5819292CHBO4
HY-W083026-01(E) -CHBO4

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