| CAS Number | 1311317-86-8 |
| Catalog Number | AG01AHMZ(AGN-PC-0WOQPH) |
| Chemical Name | methyl 2-{[(1-methyl-1H-pyrazol-4-yl)methyl]amino}acetate hydrochloride |
| IUPAC Name | methyl 2-[(1-methylpyrazol-4-yl)methylamino]acetate;hydrochloride |
| InChI | InChI=1S/C8H13N3O2.ClH/c1-11-6-7(4-10-11)3-9-5-8(12)13-2;/h4,6,9H,3,5H2,1-2H3;1H |
| InChI Key | MUUYQKIDSNEZCB-UHFFFAOYSA-N |
| MDL Number | MFCD18785531 |
| Molecular Formula | C8H14ClN3O2 |
| Molecular Weight | 219.6687 |
| SMILES | Cl.COC(CNCC1=CN(C)N=C1)=O |
| Synonyms | methyl 2-{[(1-methyl-1H-pyrazol-4-yl)methyl]amino}acetate hydrochloride,
1311317-86-8,
AKOS026741223,
MCULE-1626359313,
NE55475,
EN300-75217,
Z1267773802,
|
| Complexity | 175 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 219.077g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 219.669g/mol |
| Monoisotopic Mass | 219.077g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 56.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number