| CAS Number | 1240527-07-4 |
| Catalog Number | AG01A903(AGN-PC-0WO1FT) |
| Chemical Name | 3-Methyl-[1,2]oxazolo[5,4-b]pyridine-5-sulfonyl chloride |
| IUPAC Name | 3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-sulfonyl chloride |
| InChI | InChI=1S/C7H5ClN2O3S/c1-4-6-2-5(14(8,11)12)3-9-7(6)13-10-4/h2-3H,1H3 |
| InChI Key | JGKTYJARBKWGGM-UHFFFAOYSA-N |
| MDL Number | MFCD16547585 |
| Molecular Formula | C7H5ClN2O3S |
| Molecular Weight | 232.6442 |
| SMILES | CC1C2=C(N=CC(S(Cl)(=O)=O)=C2)ON=1 |
| Synonyms | 3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-sulfonyl chloride,
3-Methylisoxazolo[5,4-b]pyridine-5-sulfonyl chloride,
1240527-07-4,
AC1Q2QBF,
MFCD16547585,
AKOS006239809,
ZINC100612849,
NE39569,
BS-13980,
EN300-63868,
|
| Complexity | 315 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 231.971g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 232.638g/mol |
| Monoisotopic Mass | 231.971g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 81.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
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Certificate of Analysis
Lot Number