| CAS Number | 1196153-02-2 |
| Catalog Number | AG01C2AK |
| Chemical Name | 2-(5-Methylpyrazin-2-YL)ethan-1-amine |
| IUPAC Name | 2-(5-methylpyrazin-2-yl)ethanamine |
| InChI | InChI=1S/C7H11N3/c1-6-4-10-7(2-3-8)5-9-6/h4-5H,2-3,8H2,1H3 |
| InChI Key | ZSJYNCBJCXFJFV-UHFFFAOYSA-N |
| MDL Number | MFCD13189958 |
| Molecular Formula | C7H11N3 |
| Molecular Weight | 137.1823 |
| SMILES | CC1=NC=C(CCN)N=C1 |
| Synonyms | 1196153-02-2,
2-(5-METHYLPYRAZIN-2-YL)ETHAN-1-AMINE,
2-(5-METHYLPYRAZIN-2-YL)ETHANAMINE,
SCHEMBL2339199,
2-(Aminoethyl)-5-methylpyrazine,
ZSJYNCBJCXFJFV-UHFFFAOYSA-N,
ZINC82410761,
AB69468,
|
| Complexity | 94.9 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 137.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 137.186g/mol |
| Monoisotopic Mass | 137.095g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 51.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.5 |
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Certificate of Analysis
Lot Number