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2-Amino-4'-fluorobenzophenone

CAT: 1596-AR-N01900-01Size: 10 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-N01900-01Size:10 Units
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CAS Number
3800-06-4
Synonyms
(2-Aminophenyl) (4-fluorophenyl) methanone
Molecular Formula
C13H10FNO
Molecular Weight
215.22
API Name
Nafronyl

Chemical Information

2-Amino-4'-fluorobenzophenone
CAS Number3800-06-4
PubChem CID9837287
IUPAC Name(2-aminophenyl)-(4-fluorophenyl)methanone
Molecular FormulaC13H10FNO
Molecular Weight215.22
XLogP3.4
Topological Polar Surface Area43.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count16
Formal Charge0
Complexity248
SMILES
C1=CC=C(C(=C1)C(=O)C2=CC=C(C=C2)F)N
InChI
InChI=1S/C13H10FNO/c14-10-7-5-9(6-8-10)13(16)11-3-1-2-4-12(11)15/h1-8H,15H2
InChIKey
FFFXIQFESQNINT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Amino-4'-fluorobenzophenone
CAS: 3800-06-4
CID: 9837287
Formula: C13H10FNO
MW: 215.22
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight215.22
XLogP33.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass215.074642105
Monoisotopic Mass215.074642105
Topological Polar Surface Area43.1 Ų
Heavy Atom Count16
Formal Charge0
Complexity248
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