Products for Research Use Only

2- (4-Fluorophenyl) -2-oxoacetaldehyde

CAT: 0127-PC109351-01Size: 250 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0127-PC109351-01Size:250 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
403-32-7
MDL Number
MFCD01733156
Purity
95%
Smiles
Fc1ccc(cc1)C(=O)C=O

Chemical Information

(4-Fluorophenyl)glyoxal
CAS Number403-32-7
PubChem CID101249
IUPAC Name2-(4-fluorophenyl)-2-oxoacetaldehyde
Molecular FormulaC8H5FO2
Molecular Weight152.12
XLogP1.9
Topological Polar Surface Area34.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count11
Formal Charge0
Complexity159
SMILES
C1=CC(=CC=C1C(=O)C=O)F
InChI
InChI=1S/C8H5FO2/c9-7-3-1-6(2-4-7)8(11)5-10/h1-5H
InChIKey
IPWSCROFORAGJW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of (4-Fluorophenyl)glyoxal
CAS: 403-32-7
CID: 101249
Formula: C8H5FO2
MW: 152.12
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight152.12
XLogP31.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass152.02735756
Monoisotopic Mass152.02735756
Topological Polar Surface Area34.1 Ų
Heavy Atom Count11
Formal Charge0
Complexity159
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