| CAS Number | 1086391-23-2 |
| Catalog Number | AG0096IQ(AGN-PC-0WR22Y) |
| Chemical Name | 3-Chloro-1H-indazole-6-carbaldehyde |
| IUPAC Name | 3-chloro-2H-indazole-6-carbaldehyde |
| InChI | InChI=1S/C8H5ClN2O/c9-8-6-2-1-5(4-12)3-7(6)10-11-8/h1-4H,(H,10,11) |
| InChI Key | OSPONTVKJJKXLJ-UHFFFAOYSA-N |
| MDL Number | MFCD11499021 |
| Molecular Formula | C8H5ClN2O |
| Molecular Weight | 180.5911 |
| SMILES | ClC1=NNC2=CC(=CC=C12)C=O |
| Synonyms | 3-Chloro-1H-indazole-6-carbaldehyde,
1086391-23-2,
FCH890389,
MFCD11499021,
ZINC31776828,
1h-indazole-6-carbaldehyde,3-chloro-,
AKOS006325003,
OR43678,
AS-40909,
3-Chloroindazole-6-carboxaldehyde,
|
| Complexity | 188 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 180.009g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 180.591g/mol |
| Monoisotopic Mass | 180.009g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 45.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number