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2-Bromo-2’-fluoroacetophenone

CAT: 1596-AR-M03354-02Size: 50 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-M03354-02Size:50 Units
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
655-15-2
Synonyms
2-Bromo-1- (2-fluorophenyl) ethanone; 1-Bromo-2'-fluoroacetophenone; 2-Bromo-1- (2-fluorophenyl) ethanone; 2-Bromo-2'-fluoroacetophenone; 2-Fluorophenacyl Bromide; o-Fluorophenacyl Bromide; Vonoprazan and Enzalutamide impurity
Molecular Formula
C8H6BrFO
Molecular Weight
217.04
API Name
Vonoprazan

Chemical Information

2-Bromo-2'-fluoroacetophenone
CAS Number655-15-2
PubChem CID2737449
IUPAC Name2-bromo-1-(2-fluorophenyl)ethanone
Molecular FormulaC8H6BrFO
Molecular Weight217.03
XLogP2.5
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count11
Formal Charge0
Complexity149
SMILES
C1=CC=C(C(=C1)C(=O)CBr)F
InChI
InChI=1S/C8H6BrFO/c9-5-8(11)6-3-1-2-4-7(6)10/h1-4H,5H2
InChIKey
QDNWNJSLWKHNTM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Bromo-2'-fluoroacetophenone
CAS: 655-15-2
CID: 2737449
Formula: C8H6BrFO
MW: 217.03
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight217.03
XLogP32.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass215.95861
Monoisotopic Mass215.95861
Topological Polar Surface Area17.1 Ų
Heavy Atom Count11
Formal Charge0
Complexity149
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes