| CAS Number | 1354954-06-5 |
| Catalog Number | AG01ABA9(AGN-PC-0WO5LV) |
| Chemical Name | 1-[(5-ethyl-4-methyl-4H-1,2,4-triazol-3-yl)methyl]piperazine |
| IUPAC Name | 1-[(5-ethyl-4-methyl-1,2,4-triazol-3-yl)methyl]piperazine |
| InChI | InChI=1S/C10H19N5/c1-3-9-12-13-10(14(9)2)8-15-6-4-11-5-7-15/h11H,3-8H2,1-2H3 |
| InChI Key | OSYUNOXLMUDBNA-UHFFFAOYSA-N |
| MDL Number | MFCD20233438 |
| Molecular Formula | C10H19N5 |
| Molecular Weight | 209.2914 |
| SMILES | CCC1N(C)C(CN2CCNCC2)=NN=1 |
| Synonyms | 1-[(5-ethyl-4-methyl-4H-1,2,4-triazol-3-yl)methyl]piperazine,
1354954-06-5,
ZINC71382301,
AKOS023892782,
MCULE-7075934913,
NE51778,
EN300-70941,
Z1695797784,
|
| Complexity | 192 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 209.164g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 209.297g/mol |
| Monoisotopic Mass | 209.164g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 46A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number