10-Acetoxy-5H-dibenz[b,f]azepine-5-carboxamide - CAS 952740-00-0
Catalog: |
BB075542 |
Product Name: |
10-Acetoxy-5H-dibenz[b,f]azepine-5-carboxamide |
CAS: |
952740-00-0 |
Synonyms: |
10-(Acetyloxy)-5H-dibenz[b,f]azepine-5-carboxamide |
IUPAC Name: | (11-carbamoylbenzo[b][1]benzazepin-5-yl) acetate |
Description: | 10-Acetoxy-5H-dibenz[b,f]azepine-5-carboxamide is an intermediate in the synthesis of Oxacarbazepine (O869250) related compounds. |
Molecular Weight: | 294.3 |
Molecular Formula: | C17H14N2O3 |
Canonical SMILES: | CC(=O)OC1=CC2=CC=CC=C2N(C3=CC=CC=C31)C(=O)N |
InChI: | InChI=1S/C17H14N2O3/c1-11(20)22-16-10-12-6-2-4-8-14(12)19(17(18)21)15-9-5-3-7-13(15)16/h2-10H,1H3,(H2,18,21) |
InChI Key: | BRJIUIARAQMVID-UHFFFAOYSA-N |
Melting Point: | >200°C |
Solubility: | Chloroform (Slightly), Methanol (Slightly) |
Appearance: | White to Pale Yellow Solid |
Storage: | 4°C |
Complexity: | 488 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 294.10044231 |
Formal Charge: | 0 |
Heavy Atom Count: | 22 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 294.10044231 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 72.6Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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