2,3-Butanediol, dinitrate

Base Information

• Chemical Name: 2,3-Butanediol, dinitrate
• CAS No.: 6423-45-6
• Molecular Formula: C4H8 N2 O6
• Molecular Weight: 180.117
• Hs Code.: 2905399090
• DSSTox Substance ID: DTXSID30982769
• Mol file: 6423-45-6.mol

Synonyms:2,3-Butanediol, dinitrate;6423-45-6;2,3-Butylene glycol dinitrate;2,3-butandiol dinitrate;2,3-butanediol dinitrate;Butane-2,3-diyl dinitrate;SCHEMBL7573943;DTXSID30982769;RVDDYBGRQLZMSB-UHFFFAOYSA-N

Chemical Property of 2,3-Butanediol, dinitrate

Chemical Property:

• Vapor Pressure: 0.204mmHg at 25°C
• Boiling Point: 216.6°C at 760 mmHg
• Flash Point: 95.4°C
• PSA: 110.10000
• Density: 1.348g/cm³
• LogP: 1.22640
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 180.03823598
• Heavy Atom Count: 12
• Complexity: 151

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C(C)O[N+](=O)[O-])O[N+](=O)[O-]

Technology Process of 2,3-Butanediol, dinitrate

There total 2 articles about 2,3-Butanediol, dinitrate 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:

d,l-2,3-butanediol (6982-25-8) → racem.-2,3-bis-nitryloxy-butane (6423-45-6)

Guidance literature:

With sulfuric acid; nitric acid;

DOI:10.1021/ja01568a070

Reference yield:

trans-2-Butene (624-64-6) → 2,3-butyleneglycol dinitrate (6423-45-6) + 3-(2-nitrooxy)-2-butanone (124855-10-3) + acetaldehyde (75-07-0,9002-91-9)

Guidance literature:

With nitrate radical; at 24.9 ℃; under 750.06 Torr; Rate constant;

DOI:10.1021/j100369a041

Reference yield:

2,3-butyleneglycol dinitrate (6423-45-6) → 2.3-butanediol (513-85-9)

Guidance literature:

With dihexylamine; at 60 ℃; Rate constant;

upstream raw materials:

trans-2-Butene

d,l-2,3-butanediol

Downstream raw materials:

2.3-butanediol

Refernces

• 1、 Barnes, Ian,Bastian, Volker,Becker, Karl H.,Tong, Zhu. "Kinetics and Products of the Reactions of NO3 with Monoalkenes, Dialkenes, and Monoterpenes". . p. 2413 - 2419. Retrieved 2007/10/02.