CID 11967912

Base Information

• Chemical Name: CID 11967912
• CAS No.: 15415-30-2
• Molecular Formula: C₃₄H₃₂N₄NiO₄
• Molecular Weight: 619.342
• NSC Number: 267102
• Mol file: 15415-30-2.mol

Synonyms:NSC267102;NSC-267102

Chemical Property of CID 11967912

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 1122°Cat760mmHg
• Flash Point: 632.4°C
• PSA: 94.32000
• Density: g/cm³
• LogP: 2.32480
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 8
• Exact Mass: 618.177697
• Heavy Atom Count: 43
• Complexity: 1390

Purity/Quality:

98.5% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C2=CC3=C(C(=C([N-]3)C=C4C(=C(C(=CC5=C(C(=C([N-]5)C=C1[N-]2)C=C)C)[N-]4)C=C)C)C)CCC(=O)O)CCC(=O)O.[Ni]
• Isomeric SMILES: CC\1=C(/C/2=C/C3=C(C(=C([N-]3)/C=C\4/C(=C(/C(=C/C5=C(C(=C([N-]5)/C=C1\[N-]2)C=C)C)/[N-]4)C=C)C)C)CCC(=O)O)CCC(=O)O.[Ni]

Technology Process of CID 11967912

There total 1 articles about CID 11967912 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:

protoporphyrin IX + nickel diacetate (373-02-4,14998-37-9,33025-09-1,94044-50-5,98268-31-6) → nickel protoporhyrin IX (15415-30-2)

Guidance literature:

In acetic acid; addn. of C34H34N4O4 in mixt. of CHCl3 and pyridine to boiling soln. of Ni-acetate in glacial acetic acid;; washing with glacial acetic acid and ether, recrystn. from pyridine and glacial acetic acid;;

upstream raw materials:

nickel diacetate