1-Butanamine, N-nitro-

Base Information

• Chemical Name: 1-Butanamine, N-nitro-
• CAS No.: 3182-75-0
• Molecular Formula: C4H10 N2 O2
• Molecular Weight: 118.136
• DSSTox Substance ID: DTXSID80185687
• Wikidata: Q83056764
• Mol file: 3182-75-0.mol

Synonyms:1-Butanamine, N-nitro-;N-butylnitramide;3182-75-0;N-Nitro-1-butanamine;N-Nitro-N-butylamine;Butylnitramine;n-Butylnitramine;CCRIS 5858;nitroazapentane;starbld0022372;SCHEMBL7132679;2-Butyl-1-oxohydrazine 1-oxide;DTXSID80185687;FCLOSAGZCUDMFV-UHFFFAOYSA-N;2-Butyl-1-oxohydrazine 1-oxide #

Chemical Property of 1-Butanamine, N-nitro-

Chemical Property:

• Vapor Pressure: 1.2mmHg at 25°C
• Boiling Point: 174.6°Cat760mmHg
• Flash Point: 59.4°C
• PSA: 57.85000
• Density: 1.016g/cm³
• LogP: 1.48190
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 118.074227566
• Heavy Atom Count: 8
• Complexity: 68.9

Purity/Quality:

N-Nitro-1-butanamine 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCN[N+](=O)[O-]

Technology Process of 1-Butanamine, N-nitro-

There total 14 articles about 1-Butanamine, N-nitro- 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:

1-phenyl-3-butylnitroamino-2-propen-1-one (99647-90-2) → butyl-nitro-amine (3182-75-0) + 3-phenylpyrazole (2458-26-6)

Guidance literature:

With hydrazine hydrate; In ethanol; at 35 - 40 ℃; for 3h; Yield given;

Reference yield:

→ butyl-nitro-amine (3182-75-0)

Guidance literature:

With piperidine;

DOI:10.1021/ja01627a083

Reference yield:

N,N-dichloro-n-butylamine (14925-83-8) → butyl-nitro-amine (3182-75-0)

Guidance literature:

With nitric acid; acetic anhydride; at 40 ℃;

upstream raw materials:

N,N-dichloro-n-butylamine

Methyl-N-nitro-N-n-butyl-carbamat

butyl-nitro-carbamic acid ethyl ester

1-cyano-1-methylethylnitrate

Downstream raw materials:

Sulfuric acid monobutyl ester

butan-1-ol

tetrahydrofuran

1-butylene