| CAS Number | 6647-89-8 |
| Catalog Number | AG019W7A(AGN-PC-0WBCJJ) |
| Chemical Name | methyl 2-(4-amino-1H-pyrazol-1-yl)acetate hydrochloride |
| IUPAC Name | methyl 2-(4-aminopyrazol-1-yl)acetate;hydrochloride |
| InChI | InChI=1S/C6H9N3O2.ClH/c1-11-6(10)4-9-3-5(7)2-8-9;/h2-3H,4,7H2,1H3;1H |
| InChI Key | LUOVVLLUZBQJTI-UHFFFAOYSA-N |
| MDL Number | MFCD12912891 |
| Molecular Formula | C6H10ClN3O2 |
| Molecular Weight | 191.6155 |
| SMILES | Cl.COC(CN1N=CC(N)=C1)=O |
| Synonyms | methyl 2-(4-amino-1H-pyrazol-1-yl)acetate hydrochloride,
6647-89-8,
MFCD12912891,
methyl (4-amino-1H-pyrazol-1-yl)acetate hydrochloride,
AC1Q3BXX,
CTK6J2566,
AKOS016905280,
MCULE-6733717761,
EN300-50924,
methyl 2-(4-aminopyrazol-1-yl)acetate hydrochloride,
Z752371290,
C6H10ClN3O2,
N/A,
|
| Complexity | 151 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 191.046g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 191.615g/mol |
| Monoisotopic Mass | 191.046g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 70.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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