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3-Fluoropyrazin-2-amine

CAT: 0127-PC53161Size: 1 EachDry Ice: NoHazardous: No
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CAT#:0127-PC53161Size:1 Each
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CAS Number
1206523-95-6
MDL Number
MFCD23382413
Purity
=95%
Smiles
Nc1nccnc1F
Storage Conditions
Store at 2-8°C

Chemical Information

3-Fluoropyrazin-2-amine
CAS Number1206523-95-6
PubChem CID67260060
IUPAC Name3-fluoropyrazin-2-amine
Molecular FormulaC4H4FN3
Molecular Weight113.09
XLogP-0.1
Topological Polar Surface Area51.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Heavy Atom Count8
Formal Charge0
Complexity77
SMILES
C1=CN=C(C(=N1)N)F
InChI
InChI=1S/C4H4FN3/c5-3-4(6)8-2-1-7-3/h1-2H,(H2,6,8)
InChIKey
DNJZLUMLBIJZEO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-Fluoropyrazin-2-amine
CAS: 1206523-95-6
CID: 67260060
Formula: C4H4FN3
MW: 113.09
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight113.09
XLogP3-0.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Exact Mass113.03892530
Monoisotopic Mass113.03892530
Topological Polar Surface Area51.8 Ų
Heavy Atom Count8
Formal Charge0
Complexity77.7
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