Account (10S,11S)-8-chloro-11-((methylamino)methyl)-10,11-dihydrodibenzo[b,f]oxepine-10-carboxylic acid
- Catalog No. :
- ACFCQI576
- CAS No. :
- 912355-99-8
- Molecular Formula :
- C17H16ClNO3
- Molecular Weight :
- 317.77
IUPAC Name:(10S,11S)-8-chloro-11-((methylamino)methyl)-10,11-dihydrodibenzo[b,f]oxepine-10-carboxylic acid
![(10S,11S)-8-chloro-11-((methylamino)methyl)-10,11-dihydrodibenzo[b,f]oxepine-10-carboxylic acid structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | (10S,11S)-8-chloro-11-((methylamino)methyl)-10,11-dihydrodibenzo[b,f]oxepine-10-carboxylic acid |
|---|---|
| IUPAC Name | (10S,11S)-8-chloro-11-((methylamino)methyl)-10,11-dihydrodibenzo[b,f]oxepine-10-carboxylic acid |
| Molecular Formula | C17H16ClNO3 |
| Molecular Weight | 317.77 |
| SMILES | O=C([C@H]1[C@H](CNC)C2=CC=CC=C2OC3=CC=C(Cl)C=C13)O |
| InChI Key | FDEBVKYOGYXKFY-CZUORRHYSA-N |
| Synonym | (10S,11S)-8-chloro-11-((MethylaMino)Methyl)-10,11-dihydrodibenzo[b,f]oxepine-10-carboxylic acid;Dibenz[b,f]oxepin-10-carboxylic acid, 8-chloro-10,11-dihydro-11-[(methylamino)methyl]-, (10R,11R)-rel- |
| CAS No. | 912355-99-8 |
Safety Data
- Pictogram
- Signal Word
- Warning
- Hazard Statement(s)
- H302-H315-H319-H335
- Precautionary Statement(s)
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Synthetic Route by SureRoute
2. ACFCQI576 Molecular Building Block Synthetic Route
trans-11-Chloro-2-methyl-2,3,3a,12b-tetrahydro-1H-dibenzo[2,3:6,7]oxepino[4,5-c]pyrrol-1-one
11-Chloro-2-methyl-2,3,3a,12b-tetrahydro-1H-dibenzo[2,3:6,7]oxepino[4,5-c]pyrrol-1-one
rel-(3aR,12bS)-11-chloro-2-methyl-2,3,3a,12b-tetrahydro-1H-dibenzo[2,3:6,7]oxepino[4,5-c]pyrrol-1-one