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2,3-Dimethyl-5-Ethylpyrazine

CAT: 0013-GTR19258883-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19258883-01Size:50 mg
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Description
2,3-Dimethyl-5-Ethylpyrazine is a pyrazine compound widely used in biochemical experiments and drug synthesis research.
CAS Number
15707-34-3
Purity
99.27% (May vary between batches)
Smiles
N=1C=C (N=C (C1C) C) CC
Molecular Formula
C8H12N2
Molecular Weight
136.19
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

5-Ethyl-2,3-dimethylpyrazine

5-Ethyl-2,3-dimethylpyrazine is a member of pyrazines.

CAS Number15707-34-3
PubChem CID27460
IUPAC Name5-ethyl-2,3-dimethylpyrazine
Molecular FormulaC8H12N2
Molecular Weight136.19
XLogP1.4
Topological Polar Surface Area25.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count10
Formal Charge0
Complexity103
SMILES
CCC1=CN=C(C(=N1)C)C
InChI
InChI=1S/C8H12N2/c1-4-8-5-9-6(2)7(3)10-8/h5H,4H2,1-3H3
InChIKey
CIBKSMZEVHTQLG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-Ethyl-2,3-dimethylpyrazine
CAS: 15707-34-3
CID: 27460
Formula: C8H12N2
MW: 136.19
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight136.19
XLogP31.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass136.100048391
Monoisotopic Mass136.100048391
Topological Polar Surface Area25.8 Ų
Heavy Atom Count10
Formal Charge0
Complexity103
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