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6-morpholin-4-ylpyrazin-2-amine

CAT: 1731-BG FA 0654-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:1731-BG FA 0654-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
717847-03-5
MDL Number
MFCD05722015
Purity
0.95
Smiles
Nc1cncc (N2CCOCC2) n1
Shipping Conditions
Room temperature, no cold chain required

Chemical Information

6-Morpholinopyrazin-2-amine
CAS Number717847-03-5
PubChem CID45789813
IUPAC Name6-morpholin-4-ylpyrazin-2-amine
Molecular FormulaC8H12N4O
Molecular Weight180.21
XLogP-0.5
Topological Polar Surface Area64.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Heavy Atom Count13
Formal Charge0
Complexity160
SMILES
C1COCCN1C2=NC(=CN=C2)N
InChI
InChI=1S/C8H12N4O/c9-7-5-10-6-8(11-7)12-1-3-13-4-2-12/h5-6H,1-4H2,(H2,9,11)
InChIKey
PTQRJZXZMRXHBW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 6-Morpholinopyrazin-2-amine
CAS: 717847-03-5
CID: 45789813
Formula: C8H12N4O
MW: 180.21
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight180.21
XLogP3-0.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Exact Mass180.10111102
Monoisotopic Mass180.10111102
Topological Polar Surface Area64.3 Ų
Heavy Atom Count13
Formal Charge0
Complexity160
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