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2-Fluorobenzamide

CAT: 0013-GTR19251684-01Size: 200 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19251684-01Size:200 mg
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Description
2-Fluorobenzamide
CAS Number
445-28-3
Purity
97.43% (May vary between batches)
Smiles
NC (=O) C1=C (F) C=CC=C1
Molecular Formula
C7H6FNO
Molecular Weight
139.13
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2-Fluorobenzamide

structure in first source

CAS Number445-28-3
PubChem CID67964
IUPAC Name2-fluorobenzamide
Molecular FormulaC7H6FNO
Molecular Weight139.13
XLogP0.6
Topological Polar Surface Area43.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count10
Formal Charge0
Complexity138
SMILES
C1=CC=C(C(=C1)C(=O)N)F
InChI
InChI=1S/C7H6FNO/c8-6-4-2-1-3-5(6)7(9)10/h1-4H,(H2,9,10)
InChIKey
KGGHWIKBOIQEAJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Fluorobenzamide
CAS: 445-28-3
CID: 67964
Formula: C7H6FNO
MW: 139.13
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight139.13
XLogP30.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass139.043341977
Monoisotopic Mass139.043341977
Topological Polar Surface Area43.1 Ų
Heavy Atom Count10
Formal Charge0
Complexity138
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

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