AC1MXKES
4-(4-tert-butylphenyl)sulfonyl-6-chloro-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid
Also Known As: KS-00003DV6|4-{[4-(tert-butyl)phenyl]sulfonyl}-6-chloro-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid|7X-0282|4-(4-tert-butylphenyl)sulfonyl-6-chloro-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid|4-(4-tert-butylbenzenesulfonyl)-6-chloro-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid|4-(4-tert-butylbenzenesulfonyl)-6-chloro-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid|4-(4-tert-butylbenzenesulfonyl)-6-chloro-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylicacid|4-([4-(TERT-BUTYL)PHENYL]SULFONYL)-6-CHLORO-3,4-DIHYDRO-2H-1,4-BENZOXAZINE-2-CARBOXYLIC ACID|4-(4-tert-Butylbenzene-1-sulfonyl)-6-chloro-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid|6-Chloro-4-[[4-(1,1-dimethylethyl)phenyl]sulfonyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid
| Molecular Formula | C19H20ClNO5S |
|---|---|
| Molecular Weight | 409.07507 g/mol |
| LogP | 3.6784 |
| Topological Polar Surface Area | 83.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 409.07507 |
| Monoisotopic Mass | 409.07507 |
| Heavy Atoms | 27 |
| Complexity | 980.14984 |
Chemical Identifiers
| CAS Number | 866134-75-0 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CC(OC3=C2C=C(C=C3)Cl)C(=O)O |
Product Overview
AC1MXKES (CAS 866134-75-0), with molecular formula C19H20ClNO5S and molecular weight 409.07507 g/mol. IUPAC: 4-(4-tert-butylphenyl)sulfonyl-6-chloro-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid.
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