N'-[(E)-1,3-Benzodioxol-5-ylmethylidene]benzohydrazide

Base Information

• Chemical Name: N'-[(E)-1,3-Benzodioxol-5-ylmethylidene]benzohydrazide
• CAS No.: 5327-23-1
• Molecular Formula: C15H12 N2 O3
• Molecular Weight: 268.272
• NSC Number: 3300
• DSSTox Substance ID: DTXSID30425969
• Mol file: 5327-23-1.mol

Synonyms:N'-[(E)-1,3-Benzodioxol-5-ylmethylidene]benzohydrazide;N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]benzamide;5327-23-1;MLS002637681;NSC3300;BENZOIC ACID, PIPERONYLIDENEHYDRAZIDE;Piperonal benzoylhydrazone;DTXSID30425969;LDCJHBPONKAQST-CXUHLZMHSA-N;HMS1703G10;NSC-3300;STK391336;AKOS000611811;N'-[(E)-1,3-Benzodioxol-5-ylmethylidene]benzohydrazide #;N'~1~-(1,3-BENZODIOXOL-5-YLMETHYLENE)BENZOHYDRAZIDE

Chemical Property of N'-[(E)-1,3-Benzodioxol-5-ylmethylidene]benzohydrazide

Chemical Property:

• XLogP3: 2.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 268.08479225
• Heavy Atom Count: 20
• Complexity: 366

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1OC2=C(O1)C=C(C=C2)C=NNC(=O)C3=CC=CC=C3
• Isomeric SMILES: C1OC2=C(O1)C=C(C=C2)/C=N/NC(=O)C3=CC=CC=C3

Technology Process of N'-[(E)-1,3-Benzodioxol-5-ylmethylidene]benzohydrazide

There total 2 articles about N'-[(E)-1,3-Benzodioxol-5-ylmethylidene]benzohydrazide which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 96.0%

piperonal (120-57-0,30024-74-9) + benzoic acid hydrazide (613-94-5) → (E)-N′-(benzo[d][1,3]dioxol-5-ylmethylene)benzohydrazide (5327-23-1)

Guidance literature:

With water; acetic acid; In neat (no solvent); at 20 ℃; for 0.0333333h; stereoselective reaction; Green chemistry;

DOI:10.1039/c7gc00730b

Reference yield:

piperonal (120-57-0,30024-74-9) + benzoic acid hydrazide (613-94-5) → C15H12N2O3 (5327-23-1)

Guidance literature:

In methanol; for 2h; Reflux;

DOI:10.1016/j.bmcl.2011.11.059

Reference yield: 88.0%

bis-triphenylphosphine-palladium(II) chloride (13965-03-2) + (E)-N′-(benzo[d][1,3]dioxol-5-ylmethylene)benzohydrazide (5327-23-1) → C30H22N4O6Pd

Guidance literature:

With triethylamine; In methanol; chloroform; Reflux;

DOI:10.1002/ejic.201900781

upstream raw materials:

piperonal

benzoic acid hydrazide

Downstream raw materials:

1-[2-(benzo[d][1,3]dioxol-5-yl)-5-phenyl-1,3,4-oxadiazol-3(2H)-yl]ethanone