| CAS Number | 1363380-68-0 |
| Catalog Number | AG00HUIZ(AGN-PC-0WCKQQ) |
| Chemical Name | 2-Methyl-2H-indazole-7-sulfonyl chloride |
| IUPAC Name | 2-methylindazole-7-sulfonyl chloride |
| InChI | InChI=1S/C8H7ClN2O2S/c1-11-5-6-3-2-4-7(8(6)10-11)14(9,12)13/h2-5H,1H3 |
| InChI Key | OKGUGXQXIHUXDI-UHFFFAOYSA-N |
| MDL Number | MFCD21642054 |
| Molecular Formula | C8H7ClN2O2S |
| Molecular Weight | 230.6714 |
| SMILES | CN1N=C2C(=CC=CC2=C1)S(=O)(=O)Cl |
| Synonyms | 2-METHYL-2H-INDAZOLE-7-SULFONYL CHLORIDE,
1363380-68-0,
AKOS024155486,
ZINC103539420,
PB37587,
SB19970,
CS-0057278,
Q-3326,
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| Complexity | 314 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 229.992g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 230.666g/mol |
| Monoisotopic Mass | 229.992g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 60.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
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Certificate of Analysis
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