Structure

Cobalt(ii)2,3-naphthalocyanine

CAS
26603-20-3
Catalog Number
ACM26603203
Category
Organic & Printed Electronics
Molecular Weight
771.7g/mol
Molecular Formula
C48H24CoN8

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Specification

Synonyms
Cobalt(II) 2,3-naphthalocyanine;Cobalt(II) 2,3-naphthalocyanine Dye content 85 %
IUPAC Name
cobalt(2+);2,15,28,41,53,55-hexaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27(55),28,30,32,34,36,38,40,42(53),43,45,47,49,51-heptacosaene
Canonical SMILES
C1=CC=C2C=C3C(=CC2=C1)C4=NC5=NC(=NC6=C7C=C8C=CC=CC8=CC7=C([N-]6)N=C9C1=CC2=CC=CC=C2C=C1C(=N9)N=C3[N-]4)C1=CC2=CC=CC=C2C=C15.[Co+2]
InChI
InChI=1S/C48H24N8.Co/c1-2-10-26-18-34-33(17-25(26)9-1)41-49-42(34)54-44-37-21-29-13-5-6-14-30(29)22-38(37)46(51-44)56-48-40-24-32-16-8-7-15-31(32)23-39(40)47(52-48)55-45-36-20-28-12-4-3-11-27(28)19-35(36)43(50-45)53-41;/h1-24H;/q-2;+2
InChI Key
PCLONZCDFMRSKV-UHFFFAOYSA-N
Complexity
1550
Covalently-Bonded Unit Count
2
Exact Mass
771.145586g/mol
Formal Charge
0
H-Bond Acceptor
4
H-Bond Donor
0
Heavy Atom Count
57
Monoisotopic Mass
771.145586g/mol
Rotatable Bond Count
0
What is the molecular formula of Cobalt(ii)2,3-naphthalocyanine?

The molecular formula of Cobalt(ii)2,3-naphthalocyanine is C48H24CoN8.

What is the molecular weight of Cobalt(ii)2,3-naphthalocyanine?

The molecular weight of Cobalt(ii)2,3-naphthalocyanine is 771.7 g/mol.

What are some synonyms for Cobalt(ii)2,3-naphthalocyanine?

Some synonyms for Cobalt(ii)2,3-naphthalocyanine include Cobalt(2+);2,15,28,41,53,55-hexaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27(55),28,30,32,34,36,38,40,42(53),43,45,47,49,51-heptacosaene.

What is the IUPAC name of Cobalt(ii)2,3-naphthalocyanine?

The IUPAC name of Cobalt(ii)2,3-naphthalocyanine is cobalt(2+);2,15,28,41,53,55-hexaza-54,56-diazanidatridecacyclo[40.10.1.1 3,14 .1 16,27 .1 29,40 .0 4,13 .0 6,11 .0 17,26 .0 19,24 .0 30,39 .0 32,37 .0 43,52 .0 45,50 ]hexapentaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27(55),28,30,32,34,36,38,40,42(53),43,45,47,49,51-heptacosaene.

What is the InChIKey of Cobalt(ii)2,3-naphthalocyanine?

The InChIKey of Cobalt(ii)2,3-naphthalocyanine is PCLONZCDFMRSKV-UHFFFAOYSA-N.

What is the CAS number of Cobalt(ii)2,3-naphthalocyanine?

The CAS number of Cobalt(ii)2,3-naphthalocyanine is 26603-20-3.

How many hydrogen bond acceptors does Cobalt(ii)2,3-naphthalocyanine have?

Cobalt(ii)2,3-naphthalocyanine has 4 hydrogen bond acceptors.

What is the topological polar surface area of Cobalt(ii)2,3-naphthalocyanine?

The topological polar surface area of Cobalt(ii)2,3-naphthalocyanine is 76.2 Ų.

How many heavy atoms does Cobalt(ii)2,3-naphthalocyanine contain?

Cobalt(ii)2,3-naphthalocyanine contains 57 heavy atoms.

What is the formal charge of Cobalt(ii)2,3-naphthalocyanine?

The formal charge of Cobalt(ii)2,3-naphthalocyanine is 0.

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