AC1LBA3L
8-chloro-1-hydroxy-9-methoxy-3,7,10-trimethyl-6-oxobenzo[b][1,4]benzodioxepine-2-carbaldehyde
Also Known As: 2-Chloro-6-hydroxy-3-methoxy-1,4,8-trimethyl-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-7-carbaldehyde|2-Chloro-6-hydroxy-3-methoxy-1,4,8-trimethyl-11-oxo-11H-dibenzo[b,E][1,4]dioxepine-7-carbaldehyde|11H-Dibenzo[b,e][1,4]dioxepin-7-carboxaldehyde, 2-chloro-6-hydroxy-3-methoxy-1,4,8-trimethyl-11-oxo-|13-chloro-4-hydroxy-14-methoxy-6,12,15-trimethyl-10-oxo-2,9-dioxatricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaene-5-carbaldehyde|2-Chloro-6-hydroxy-3-methoxy-1,4,8-trimethyl-11-oxo-11H-dibenzo[b,E][1,4]dioxepine-7-carbaldehyde #|8-chloro-1-hydroxy-9-methoxy-3,7,10-trimethyl-6-oxobenzo[b][1,4]benzodioxepine-2-carbaldehyde
| Molecular Formula | C18H15ClO6 |
|---|---|
| Molecular Weight | 362.05573 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 82.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 362.05573 |
| Monoisotopic Mass | 362.05573 |
| Heavy Atoms | 25 |
| Complexity | 528.0 |
Chemical Identifiers
| CAS Number | 489-30-5 |
|---|---|
| SMILES | CC1=CC2=C(C(=C1C=O)O)OC3=C(C(=C(C(=C3C(=O)O2)C)Cl)OC)C |
| InChIKey | GXLRAMMQUGVYLZ-UHFFFAOYSA-N |
Product Overview
AC1LBA3L (CAS 489-30-5), with molecular formula C18H15ClO6 and molecular weight 362.05573 g/mol. IUPAC: 8-chloro-1-hydroxy-9-methoxy-3,7,10-trimethyl-6-oxobenzo[b][1,4]benzodioxepine-2-carbaldehyde.