![7-Chloro-1,2,3,4-tetrahydrobenzo[b]azepin-5-one](https://resource.bocsci.com/structure/160129-45-3.gif)
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| IUPAC Name: | 7-chloro-1,2,3,4-tetrahydro-1-benzazepin-5-one |
| Description: | 7-Chloro-1,2,3,4-tetrahydrobenzo[b]azepin-5-one (CAS# 160129-45-3) is an intermediate in the synthesis of Tolvaptan (T536650) (OPC-41061), an orally active nonpeptide arginine vasopressin V2 receptor antagonist. |
| Molecular Weight: | 195.65 |
| Molecular Formula: | C10H10ClNO |
| Canonical SMILES: | C1CC(=O)C2=C(C=CC(=C2)Cl)NC1 |
| InChI: | InChI=1S/C10H10ClNO/c11-7-3-4-9-8(6-7)10(13)2-1-5-12-9/h3-4,6,12H,1-2,5H2 |
| InChI Key: | AHESNFIUAHTYGS-UHFFFAOYSA-N |
| Boiling Point: | 356.5 °C at 760 mmHg |
| Purity: | 98.0% |
| Density: | 1.234 g/cm3 |
| MDL: | MFCD06738694 |
| LogP: | 2.86640 |
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Carbonyl Compounds
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
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