Nickel phthalocyanine

• CAS: 14055-02-8
• Catalog Number: ACM14055028
• Category: Organic & Printed Electronics
• Molecular Weight: 571.22
• Molecular Formula: C32H16N8Ni
• Synonyms: 2,1-Phthalocyaninato nickel
• IUPAC Name: 2,11,20,29,37,39-hexaza-38,40-diazanidanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3,5,7,9,11,13,15,17,19(39),20,22,24,26,28,30(37),31,33,35-nonadecaene;nickel(2+)
• Canonical SMILES: C1=CC=C2C(=C1)C3=NC4=NC(=NC5=C6C=CC=CC6=C([N-]5)N=C7C8=CC=CC=C8C(=N7)N=C2[N-]3)C9=CC=CC=C94.[Ni+2]
• InChI: InChI=1S/C32H16N8.Ni/c1-2-10-18-17(9-1)25-33-26(18)38-28-21-13-5-6-14-22(21)30(35-28)40-32-24-16-8-7-15-23(24)31(36-32)39-29-20-12-4-3-11-19(20)27(34-29)37-25;/h1-16H;/q-2;+2
• InChI Key: LVIYYTJTOKJJOC-UHFFFAOYSA-N
• Melting Point: >300 °C
• Appearance: Very dark blue crystalline powder
• Complexity: 1080
• Covalently-Bonded Unit Count: 2
• EC Number: 237-893-3
• Exact Mass: 570.085134g/mol
• Formal Charge: 0
• H-Bond Acceptor: 4
• H-Bond Donor: 0
• Heavy Atom Count: 41
• Monoisotopic Mass: 570.085134g/mol
• Rotatable Bond Count: 0

Custom Q&A

What is the molecular formula of Nickel phthalocyanine?

The molecular formula of Nickel phthalocyanine is C32H16N8Ni.

What are the synonyms of Nickel phthalocyanine?

The synonyms of Nickel phthalocyanine include Nickel phthalocyanine 2,11,20,29,37,39-Hexaza-38,40-diazanidanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3,5,7,9,11,13,15,17,19(39),20,22,24,26,28,30(37),31,33,35-nonadecaene and nickel(2+) MFCD00041954.

What is the molecular weight of Nickel phthalocyanine?

The molecular weight of Nickel phthalocyanine is 571.2 g/mol.

What is the parent compound of Nickel phthalocyanine?

The parent compound of Nickel phthalocyanine is CID 86280045 (Phthalocyanine).

What are the component compounds of Nickel phthalocyanine?

The component compounds of Nickel phthalocyanine are CID 86280045 (Phthalocyanine) and CID 5282330 (31h-Phthalocyanine) CID 935 (Nickel).

When was Nickel phthalocyanine created?

Nickel phthalocyanine was created on July 19, 2005.

When was Nickel phthalocyanine last modified?

Nickel phthalocyanine was last modified on December 2, 2023.

What is the IUPAC name of Nickel phthalocyanine?

The IUPAC name of Nickel phthalocyanine is 2,11,20,29,37,39-hexaza-38,40-diazanidanonacyclo[28.6.1.1 3,10 .1 12,19 .1 21,28 .0 4,9 .0 13,18 .0 22,27 .0 31,36 ]tetraconta-1,3,5,7,9,11,13,15,17,19(39),20,22,24,26,28,30(37),31,33,35-nonadecaene;nickel(2+).

What is the InChI of Nickel phthalocyanine?

The InChI of Nickel phthalocyanine is InChI=1S/C32H16N8.Ni/c1-2-10-18-17(9-1)25-33-26(18)38-28-21-13-5-6-14-22(21)30(35-28)40-32-24-16-8-7-15-23(24)31(36-32)39-29-20-12-4-3-11-19(20)27(34-29)37-25;/h1-16H;/q-2;+2.

What is the Canonical SMILES of Nickel phthalocyanine?

The Canonical SMILES of Nickel phthalocyanine is C1=CC=C2C(=C1)C3=NC4=NC(=NC5=C6C=CC=CC6=C([N-]5)N=C7C8=CC=CC=C8C(=N7)N=C2[N-]3)C9=CC=CC=C94.[Ni+2].