1,6-Dinitronaphthalen-2-ol

Base Information

• Chemical Name: 1,6-Dinitronaphthalen-2-ol
• CAS No.: 606-79-1
• Molecular Formula: C10H6N2O5
• Molecular Weight: 234.168
• NSC Number: 128132
• DSSTox Substance ID: DTXSID20299090
• Wikidata: Q82041283
• Mol file: 606-79-1.mol

Synonyms:606-79-1;1,6-dinitronaphthalen-2-ol;NSC128132;SCHEMBL7909511;DTXSID20299090;NSC-128132

Chemical Property of 1,6-Dinitronaphthalen-2-ol

Chemical Property:

• Vapor Pressure: 1.52E-07mmHg at 25°C
• Boiling Point: 416.9°Cat760mmHg
• Flash Point: 184°C
• Density: 1.607g/cm³
• XLogP3: 3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 0
• Exact Mass: 234.02767130
• Heavy Atom Count: 17
• Complexity: 324

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC2=C(C=CC(=C2[N+](=O)[O-])O)C=C1[N+](=O)[O-]

Technology Process of 1,6-Dinitronaphthalen-2-ol

There total 11 articles about 1,6-Dinitronaphthalen-2-ol 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: 78.0%

β-naphthol (135-19-3) → 1-nitro-2-naphthol (550-60-7) + 1,6-dinitro-2-naphthol (606-79-1)

Guidance literature:

With aluminium trinitrate; In acetonitrile; at 0 ℃;

DOI:10.1021/acs.orglett.8b04141

Reference yield: 68.0%

1-Nitroso-2-naphthol (131-91-9) → 1-nitro-2-naphthol (550-60-7) + 1,6-dinitro-2-naphthol (606-79-1)

Guidance literature:

With oxygen; nitrogen(II) oxide; In benzene; at 20 ℃; for 2h;

DOI:10.1002/1099-0690(200212)2002:23<4011::AID-EJOC4011<3.0.CO;2-6

Reference yield: 46.0%

2-hydroxynaphthalene-1-carbaldehyde (708-06-5) → 1,6-dinitro-2-naphthol (606-79-1) + 2-hydroxy-6-nitro-1-naphthaldehyde (53653-22-8)

Guidance literature:

With nitric acid; In water; at -5 ℃; for 0.166667h;

DOI:10.1016/S0040-4020(01)00189-2

upstream raw materials:

nitric acid

Sudan I

acetic acid

1-(4-methylphenylazo)naphthalen-2-ol

Downstream raw materials:

2-β-Carboxyvinyl-4-nitrophenylhydroxamsaeure

(2R,3R,4S,5R,6S)-3,4,5-Tris-benzyloxy-2-benzyloxymethyl-6-(1,6-dinitro-naphthalen-2-yloxy)-tetrahydro-pyran

(2R,3R,4S,5R,6R)-3,4,5-Tris-benzyloxy-2-benzyloxymethyl-6-(1,6-dinitro-naphthalen-2-yloxy)-tetrahydro-pyran

4-nitrophthalic acid