N'-(1-Methylazepan-4-yl)benzohydrazide Hydrochloride
Catalog: |
BB059947 |
Product Name: |
N'-(1-Methylazepan-4-yl)benzohydrazide Hydrochloride |
Synonyms: |
Azelastine HCl Impurity B; N'-(1-methylazepan-4-yl)benzohydrazide; hydrochloride; 1-METHYL-4-(2-BENZOYLHYDRAZINO)AZEPAN HYDROCHLORIDE; Azelastine Related Compound B |
IUPAC Name: | N'-(1-methylazepan-4-yl)benzohydrazidehydrochloride |
Description: | N'-(1-Methylazepan-4-yl)benzohydrazide Hydrochloride is a useful reagent for the preparation of antiallergy agents. |
Molecular Weight: | 247.34 + x(36.46) |
Molecular Formula: | C14H21N3O·xHCl |
Canonical SMILES: | CN1CCCC(CC1)NNC(=O)C2=CC=CC=C2.Cl |
InChI: | InChI=1S/C14H21N3O.ClH/c1-17-10-5-8-13(9-11-17)15-16-14(18)12-6-3-2-4-7-12/h2-4,6-7,13,15H,5,8-11H2,1H3,(H,16,18)1H |
InChI Key: | LBMOWZCEDIZQOM-UHFFFAOYSA-N |
Storage: | Hygroscopic, Refrigerator, under inert atmosphere |
References: | Engel, J., & Scheffler, G. Ger. Offen. (1987), DE 3634942 A1. |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P301+P317, P330, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113045547-A | Preparation method of azelastine hydrochloride | 20191227 |
Complexity: | 264 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 283.14514 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 283.14514 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 44.4Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
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