| CAS Number | 1152506-12-1 |
| Catalog Number | AG019Y5Y(AGN-PC-0WO1FJ) |
| Chemical Name | 5-(5-Methylfuran-2-yl)-1,2,4-triazin-3-amine |
| IUPAC Name | 5-(5-methylfuran-2-yl)-1,2,4-triazin-3-amine |
| InChI | InChI=1S/C8H8N4O/c1-5-2-3-7(13-5)6-4-10-12-8(9)11-6/h2-4H,1H3,(H2,9,11,12) |
| InChI Key | HFJIFURWSWKXBG-UHFFFAOYSA-N |
| MDL Number | MFCD11101843 |
| Molecular Formula | C8H8N4O |
| Molecular Weight | 176.1753 |
| SMILES | CC1OC(C2=NC(N)=NN=C2)=CC=1 |
| Synonyms | 5-(5-methylfuran-2-yl)-1,2,4-triazin-3-amine,
1152506-12-1,
AC1Q2MP5,
CTK7E1548,
ZINC34959340,
AKOS008121637,
MCULE-4276794209,
NE40066,
EN300-57158,
|
| Complexity | 178 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 176.07g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 176.179g/mol |
| Monoisotopic Mass | 176.07g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 77.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number