| CAS Number | 1094296-86-2 |
| Catalog Number | AG019Y4D(AGN-PC-0WO7B2) |
| Chemical Name | 5-(2-fluorophenyl)-1,2,4-triazin-3-amine |
| IUPAC Name | 5-(2-fluorophenyl)-1,2,4-triazin-3-amine |
| InChI | InChI=1S/C9H7FN4/c10-7-4-2-1-3-6(7)8-5-12-14-9(11)13-8/h1-5H,(H2,11,13,14) |
| InChI Key | JBYPLQMUAUUGNW-UHFFFAOYSA-N |
| MDL Number | MFCD11134109 |
| Molecular Formula | C9H7FN4 |
| Molecular Weight | 190.1771 |
| SMILES | NC1=NC(C2=C(F)C=CC=C2)=CN=N1 |
| Synonyms | 5-(2-fluorophenyl)-1,2,4-triazin-3-amine,
1094296-86-2,
AC1Q52KD,
SCHEMBL2324805,
CTK7E1555,
ZINC36722181,
AKOS008121717,
MCULE-8424779833,
NE34737,
EN300-56968,
|
| Complexity | 190 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 190.065g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 190.181g/mol |
| Monoisotopic Mass | 190.065g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 64.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number