| CAS Number | 885519-78-8 |
| Catalog Number | AG00GZSY(AGN-PC-0WD87H) |
| Chemical Name | 3-FORMYL-4-INDAZOLECARBOXYLIC ACID |
| IUPAC Name | 3-formyl-2H-indazole-4-carboxylic acid |
| InChI | InChI=1S/C9H6N2O3/c12-4-7-8-5(9(13)14)2-1-3-6(8)10-11-7/h1-4H,(H,10,11)(H,13,14) |
| InChI Key | DAPWQPGPGVUFLB-UHFFFAOYSA-N |
| MDL Number | MFCD07781429 |
| Molecular Formula | C9H6N2O3 |
| Molecular Weight | 190.1555 |
| SMILES | O=C(C1=CC=CC2=C1C(C=O)=NN2)O |
| Synonyms | 3-formyl-1h-indazole-4-carboxylic acid,
885519-78-8,
3-Formyl-4-indazolecarboxylic acid,
SCHEMBL6284919,
ZINC14984559,
AKOS006285678,
1h-indazole-4-carboxylic acid,3-formyl-,
CS-0055957,
FT-0732183,
3-formyl-4-indazolecarboxylic acid, AldrichCPR,
W-3252,
|
| Complexity | 256 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 190.038g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 190.158g/mol |
| Monoisotopic Mass | 190.038g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 83A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number