2-Nitrophenanthrene

Base Information

• Chemical Name: 2-Nitrophenanthrene
• CAS No.: 17024-18-9
• Molecular Formula: C₁₄H₉NO₂
• Molecular Weight: 223.231
• Hs Code.: 2904209090
• UNII: PKF8VDC4N7
• DSSTox Substance ID: DTXSID70168823
• Nikkaji Number: J69.846F
• Wikidata: Q83038436
• ChEMBL ID: CHEMBL354694
• Mol file: 17024-18-9.mol

Synonyms:2-NITROPHENANTHRENE;Phenanthrene, 2-nitro-;17024-18-9;CCRIS 3370;Phenanthrene,2-nitro-;PKF8VDC4N7;BRN 2372743;2-Nitro-phenanthrene;3-Nitrophenathrene;2-Nitro-phenanthren;UNII-PKF8VDC4N7;CHEMBL354694;SCHEMBL1527627;DTXSID70168823;LS-102680

Chemical Property of 2-Nitrophenanthrene

Chemical Property:

• Vapor Pressure: 5.33E-07mmHg at 25°C
• Melting Point: 99°C
• Refractive Index: 1.4700 (estimate)
• Boiling Point: 423.9°Cat760mmHg
• Flash Point: 214.7°C
• PSA: 45.82000
• Density: 1.316g/cm³
• LogP: 4.42440
• XLogP3: 4.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 223.063328530
• Heavy Atom Count: 17
• Complexity: 299

Purity/Quality:

99% ^*data from raw suppliers

2-NITROPHENANTHRENE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C=CC3=C2C=CC(=C3)[N+](=O)[O-]

Technology Process of 2-Nitrophenanthrene

There total 21 articles about 2-Nitrophenanthrene 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%

2-nitro-9,10-dihydrophenanthrene (5329-87-3) → 2-nitrophenanthrene (17024-18-9)

Guidance literature:

With 2,3-dicyano-5,6-dichloro-p-benzoquinone; In 1,4-dioxane; for 48h; Heating;

DOI:10.1021/jo00039a049

Reference yield: 91.0%

C14H11NO3 (929554-60-9) → 2-nitrophenanthrene (17024-18-9)

Guidance literature:

With caesium carbonate; In N,N-dimethyl-formamide; at 200 ℃; for 0.75h; microwave irradiation;

DOI:10.1055/s-2006-956451

Reference yield: 90.0%

C28H25N5O6S2 (1392144-14-7) → 2-nitrophenanthrene (17024-18-9)

Guidance literature:

With dirhodium tetraacetate; lithium tert-butoxide; In toluene; at 90 ℃; for 1h; Inert atmosphere; Molecular sieve;

DOI:10.1002/anie.201201374

upstream raw materials:

phenanthrene

acetic acid-(2-nitro-fluoren-9-ylmethyl ester)

methyl 2-nitro-9H-fluorene-9-carboxylate

2-nitro-9,10-dihydrophenanthrene

Downstream raw materials:

2-nitrophenanthrene-9,10-dione

2-aminophenanthrene