2-Nitro-1-nitroso-1-pentylguanidine

Base Information

• Chemical Name: 2-Nitro-1-nitroso-1-pentylguanidine
• CAS No.: 13010-10-1
• Molecular Formula: C6H13 N5 O3
• Molecular Weight: 203.201
• Hs Code.: 2925290090
• NSC Number: 34699
• Mol file: 13010-10-1.mol

Synonyms:2-nitro-1-nitroso-1-pentylguanidine;N/'-nitro-N-pentyl-N-nitrosoguanidine;C6H13N5O3;NSC34699

Chemical Property of 2-Nitro-1-nitroso-1-pentylguanidine

Chemical Property:

• Refractive Index: 1.8500 (estimate)
• Boiling Point: 321.7°Cat760mmHg
• Flash Point: 148.4°C
• PSA: 116.87000
• Density: 1.37g/cm³
• LogP: 1.88990
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 203.10183929
• Heavy Atom Count: 14
• Complexity: 224

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCN(C(=N[N+](=O)[O-])N)N=O
• Isomeric SMILES: CCCCCN(/C(=N/[N+](=O)[O-])/N)N=O

Technology Process of 2-Nitro-1-nitroso-1-pentylguanidine

There total 2 articles about 2-Nitro-1-nitroso-1-pentylguanidine 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:

n-Pentylamine (110-58-7) → N'-nitro-N-pentyl-N-nitrosoguanidine (13010-10-1)

Guidance literature:

Multi-step reaction with 2 steps

1: H₂O

2: aq. HNO₃, NaNO₂

With nitric acid; sodium nitrite; In water;

DOI:10.1021/jm50010a005

Reference yield:

N-nitro-N'-pentyl-guanidine (35089-69-1) → N'-nitro-N-pentyl-N-nitrosoguanidine (13010-10-1)

Guidance literature:

With nitric acid; sodium nitrite;

DOI:10.1248/cpb.19.1809

Reference yield: 24.0%

etheral 1-diazopentane + N'-nitro-N-pentyl-N-nitrosoguanidine (13010-10-1) + trimethyl-(2,2-difluoro-3-phenyl-4-pentenoyl)silane (100699-86-3) → 4,4-Difluoro-3-phenyl-1-decen-5-one

Guidance literature:

With aqueous KOH; In diethyl ether; hexane; chloroform; water;

upstream raw materials:

N-nitro-N'-pentyl-guanidine

n-Pentylamine

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