| CAS Number | 1016505-59-1 |
| Catalog Number | AG009A0X(AGN-PC-0WO8CI) |
| Chemical Name | 7-Methylpyrazolo[1,5-a]pyrimidine-3-carboxylic acid |
| IUPAC Name | 7-methylpyrazolo[1,5-a]pyrimidine-3-carboxylic acid |
| InChI | InChI=1S/C8H7N3O2/c1-5-2-3-9-7-6(8(12)13)4-10-11(5)7/h2-4H,1H3,(H,12,13) |
| InChI Key | ZDHMVXYJWKLOQS-UHFFFAOYSA-N |
| MDL Number | MFCD09806068 |
| Molecular Formula | C8H7N3O2 |
| Molecular Weight | 177.1601 |
| SMILES | CC1=CC=NC=2N1N=CC2C(=O)O |
| Synonyms | 7-methylpyrazolo[1,5-a]pyrimidine-3-carboxylic acid,
1016505-59-1,
AC1Q2NYE,
SCHEMBL359062,
CTK7J0669,
DTXSID60640704,
MFCD09806068,
ZINC19414073,
AKOS000163622,
MCULE-9139510937,
AS-36470,
CS-0080360,
EN300-43719,
Z1172068249,
|
| Complexity | 221 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 177.054g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 177.163g/mol |
| Monoisotopic Mass | 177.054g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 67.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number