| CAS Number | 198765-34-3 |
| Catalog Number | AG01DKUI(AGN-PC-0QQ3OQ) |
| Chemical Name | 4-amino-1-methyl-1H-pyrrole-2-carboxylic acid hydrochloride |
| IUPAC Name | 4-amino-1-methylpyrrole-2-carboxylic acid;hydrochloride |
| InChI | InChI=1S/C6H8N2O2.ClH/c1-8-3-4(7)2-5(8)6(9)10;/h2-3H,7H2,1H3,(H,9,10);1H |
| InChI Key | UBOXAPSORVLBPX-UHFFFAOYSA-N |
| MDL Number | MFCD18782086 |
| Molecular Formula | C6H9ClN2O2 |
| Molecular Weight | 176.6009 |
| SMILES | Cl.CN1C(C(O)=O)=CC(N)=C1 |
| Synonyms | 4-Amino-1-methyl-1H-pyrrole-2-carboxylic acid HCl,
198765-34-3,
4-Amino-1-methyl-1H-pyrrole-2-carboxylic acid hydrochloride,
SCHEMBL7049628,
MFCD18782086,
AS-42308,
45776-13-4,
|
| Complexity | 149 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 176.035g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 176.6g/mol |
| Monoisotopic Mass | 176.035g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 68.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number