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Merck
CN

408883

Sigma-Aldrich

Nickel(II) 1,4,8,11,15,18,22,25-octabutoxy-29H,31H-phthalocyanine

Dye content 97 %

Synonym(s):

1,4,8,11,15,18,22,25-Octabutoxyphthalocyanine nickel(II) salt

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About This Item

Empirical Formula (Hill Notation):
C64H80N8NiO8
CAS Number:
155773-71-0
Molecular Weight:
1148.06
MDL number:
MFCD00192346
UNSPSC Code:
12352103
PubChem Substance ID:
24865603
NACRES:
NA.23

Key Documents

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composition

Dye content, 97%

reaction suitability

reagent type: catalyst
core: nickel

mp

288-293 °C (lit.)

λmax

743 nm

SMILES string

CCCCOc1ccc(OCCCC)c2c3nc(nc4n5[Ni]n6c(n3)c7c(OCCCC)ccc(OCCCC)c7c6nc8nc(nc5c9c(OCCCC)ccc(OCCCC)c49)c%10c(OCCCC)ccc(OCCCC)c8%10)c12

InChI

1S/C64H80N8O8.Ni/c1-9-17-33-73-41-25-26-42(74-34-18-10-2)50-49(41)57-65-58(50)70-60-53-45(77-37-21-13-5)29-30-46(78-38-22-14-6)54(53)62(67-60)72-64-56-48(80-40-24-16-8)32-31-47(79-39-23-15-7)55(56)63(68-64)71-61-52-44(76-36-20-12-4)28-27-43(75-35-19-11-3)51(52)59(66-61)69-57;/h25-32H,9-24,33-40H2,1-8H3;/q-2;+2

InChI key

JFVRZEMMDHQJPH-UHFFFAOYSA-N

Pictograms

Exclamation mark
GHS07

Signal Word

Warning

Hazard Statements

H317

Hazard Classifications

Skin Sens. 1

Storage Class Code

6.1D - Non-combustible acute toxic Cat.3 / toxic hazardous materials or hazardous materials causing chronic effects

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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Certificates of Analysis (COA)

Lot/Batch Number
MKBT8201V
MKBK4581V
01596LH
17514PE
12223KF

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