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N-Methylpyrazin-2-amine

CAT: 0127-OR89988-01Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0127-OR89988-01Size:250 mg
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CAS Number
32111-28-7
MDL Number
MFCD08456680
Purity
98%
Smiles
CNC1=CN=CC=N1

Chemical Information

N-Methylpyrazin-2-amine
CAS Number32111-28-7
PubChem CID16767478
IUPAC NameN-methylpyrazin-2-amine
Molecular FormulaC5H7N3
Molecular Weight109.13
XLogP0.6
Topological Polar Surface Area37.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count8
Formal Charge0
Complexity64
SMILES
CNC1=NC=CN=C1
InChI
InChI=1S/C5H7N3/c1-6-5-4-7-2-3-8-5/h2-4H,1H3,(H,6,8)
InChIKey
VGKOARVVEXZTPU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-Methylpyrazin-2-amine
CAS: 32111-28-7
CID: 16767478
Formula: C5H7N3
MW: 109.13
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight109.13
XLogP30.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass109.063997236
Monoisotopic Mass109.063997236
Topological Polar Surface Area37.8 Ų
Heavy Atom Count8
Formal Charge0
Complexity64.7
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