ADENINE N(1)-OXIDE MONOHYDRATE, 98

Base Information

• Chemical Name: ADENINE N(1)-OXIDE MONOHYDRATE, 98
• CAS No.: 700-02-7
• Molecular Formula: C5H5 N5 O
• Molecular Weight: 151.128
• Hs Code.: 2933990090
• Mol file: 700-02-7.mol

Synonyms:3H-Purin-6-amine,1-oxide (9CI); Adenine, 1-oxide (6CI,7CI,8CI); Adenine N1-oxide; NSC 110037

Chemical Property of ADENINE N(1)-OXIDE MONOHYDRATE, 98

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Melting Point: 302°C (rough estimate)
• Refractive Index: 1.9000 (estimate)
• Boiling Point: 721.524°C at 760 mmHg
• PKA: pK1: 2.69(+1);pK2: 8.49(0) (25°C)
• Flash Point: 390.164°C
• PSA: 93.05000
• Density: 2.018g/cm³
• LogP: 0.54980
• Storage Temp.: -20°C

Purity/Quality:

99%, ^*data from raw suppliers

ADENINE N1-OXIDE Aldrich ^*data from reagent suppliers

Safty Information:

• Safety Statements: S22:Do not inhale dust.; S24/25:Avoid contact with skin and eyes.

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of ADENINE N(1)-OXIDE MONOHYDRATE, 98

There total 4 articles about ADENINE N(1)-OXIDE MONOHYDRATE, 98 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: 70.1%

adenine (66224-66-6,66224-67-7,66224-68-8,66224-69-9,134434-48-3,134434-49-4,134454-76-5,134461-75-9) → adenine 1-oxide (700-02-7)

Guidance literature:

With dihydrogen peroxide; In acetic acid; for 72h; Ambient temperature;

DOI:10.1002/(SICI)1521-4184(19996)332:6<187::AID-ARDP187>3.0.CO;2-D

Reference yield:

→ adenine 1-oxide (700-02-7)

Guidance literature:

1-Methyladenin, Hydroxylaminacetat;

Reference yield:

7H-purin-6-ylamine (73-24-5,71660-29-2,71660-30-5) → 1-oxy-7(9)H-purin-6-ylamine (700-02-7)

Guidance literature:

With dihydrogen peroxide;

DOI:10.1021/ja01544a045

upstream raw materials:

7H-purin-6-ylamine

adenine

Downstream raw materials:

hypoxanthine 1-N-oxide

Refernces

• 1、 Clement,Kunze. "Microsomal N-oxygenation of adenine to adenine 1-N-oxide". . p. 25 - 27. Retrieved 1993.
• 2、 DUNN,MAGUIRE,BROWN. "Purine N-oxides. VI. The metabolism of adenine 1-N-oxide.". . p. 620 - 624. Retrieved 2007/12/02.