Carbazochrome

Base Information

• Chemical Name: Carbazochrome
• CAS No.: 69-81-8
• Molecular Formula: C10H12N4O3
• Molecular Weight: 236.23
• Hs Code.: 29339900
• European Community (EC) Number: 200-717-0
• NSC Number: 73742
• UNII: 81F061RQS4
• DSSTox Substance ID: DTXSID3048310
• Wikipedia: Carbazochrome
• Wikidata: Q1104521
• NCI Thesaurus Code: C79939
• RXCUI: 2011
• ChEMBL ID: CHEMBL2051960,CHEMBL4789892
• Mol file: 69-81-8.mol

Synonyms:AC-17;Adona;adrenochromazone;adrenochrome semicarbazone;adrenochrome semicarbazone sodium sulfonate;Adrenosem;Adrenoxyl;carbazochrome;carbazochrome salicylate;carbazochrome sodium sulfonate

Chemical Property of Carbazochrome

Chemical Property:

• Appearance/Colour: nacarat crystalline powder
• Melting Point: 203° (dec)
• Refractive Index: 1.732
• PKA: 12.38±0.40(Predicted)
• PSA: 108.02000
• Density: 1.63 g/cm³
• LogP: -0.26090
• Storage Temp.: −20°C
• Solubility.: DMSO (Slightly), Water (Slightly, Heated)
• XLogP3: 0
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 236.09094026
• Heavy Atom Count: 17
• Complexity: 336

Purity/Quality:

99% ^*data from raw suppliers

Carbazochrome ^*data from reagent suppliers

Safty Information:

• Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1CC(C2=CC(=C(C=C21)O)N=NC(=O)N)O
• Uses: Carbazochrome is an oxidation product of Epinephrine [E588580]) that improves microcirculatory tone. Derivatives such as carbazochrome salicylate and carbazochrome sodium sulfonate, are used as hemostats and treatment to prevent dengue shock syndrome, respectively.
• Therapeutic Function: Hemostatic

Technology Process of Carbazochrome

There total 6 articles about Carbazochrome 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:

adrenochrome (54-06-8) → Carbazochrome (69-81-8)

Guidance literature:

With semicarbazide hydrochloride; potassium acetate; In water; at 20 ℃; Large scale;

Reference yield:

benzene-1,2-diol (120-80-9,19481-10-8,37349-32-9) → Carbazochrome (69-81-8)

Guidance literature:

Multi-step reaction with 5 steps

1.1: aluminum (III) chloride / dichloromethane / 0 - 30 °C / Large scale

2.1: ethanol / 10 - 45 °C / Large scale

2.2: 5 h / 0 - 10 °C / Large scale

3.1: sodium tetrahydroborate; pyrographite / water / 25 °C / Large scale

4.1: potassium hexacyanoferrate(III); sodium hydrogencarbonate / water / 0.25 h / 0 - 5 °C / Large scale

5.1: semicarbazide hydrochloride; potassium acetate / water / 20 °C / Large scale

With aluminum (III) chloride; sodium tetrahydroborate; semicarbazide hydrochloride; potassium acetate; sodium hydrogencarbonate; pyrographite; potassium hexacyanoferrate(III); In ethanol; dichloromethane; water;

Reference yield:

2-chloro-3',4'-dihydroxyacetophenone (99-40-1) → Carbazochrome (69-81-8)

Guidance literature:

Multi-step reaction with 4 steps

1.1: ethanol / 10 - 45 °C / Large scale

1.2: 5 h / 0 - 10 °C / Large scale

2.1: sodium tetrahydroborate; pyrographite / water / 25 °C / Large scale

3.1: potassium hexacyanoferrate(III); sodium hydrogencarbonate / water / 0.25 h / 0 - 5 °C / Large scale

4.1: semicarbazide hydrochloride; potassium acetate / water / 20 °C / Large scale

With sodium tetrahydroborate; semicarbazide hydrochloride; potassium acetate; sodium hydrogencarbonate; pyrographite; potassium hexacyanoferrate(III); In ethanol; water;

upstream raw materials:

semicarbazide hydrochloride

adrenochrome

benzene-1,2-diol

2-chloro-3',4'-dihydroxyacetophenone

Refernces