| CAS Number | 1354950-72-3 |
| Catalog Number | AG019RTM(AGN-PC-0WOA2Z) |
| Chemical Name | 1H-Indazole-6-carboxylic acid, 4,5,6,7-tetrahydro- |
| IUPAC Name | 4,5,6,7-tetrahydro-1H-indazole-6-carboxylic acid |
| InChI | InChI=1S/C8H10N2O2/c11-8(12)5-1-2-6-4-9-10-7(6)3-5/h4-5H,1-3H2,(H,9,10)(H,11,12) |
| InChI Key | VMJCCYRJNABUBO-UHFFFAOYSA-N |
| MDL Number | MFCD20731098 |
| Molecular Formula | C8H10N2O2 |
| Molecular Weight | 166.1772 |
| SMILES | C(=O)(O)C1Cc2c(CC1)cn[nH]2 |
| Synonyms | 4,5,6,7-tetrahydro-1H-indazole-6-carboxylic acid,
1354950-72-3,
SCHEMBL17869170,
VMJCCYRJNABUBO-UHFFFAOYSA-N,
AKOS022907190,
MCULE-2125609520,
NE44288,
1H-Indazole-6-carboxylic acid, 4,5,6,7-tetrahydro-,
|
| Complexity | 196 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 166.074g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 166.18g/mol |
| Monoisotopic Mass | 166.074g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 66A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number