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Pigment Red 147

CAT: 0804-HY-D0632Size: 1 EachDry Ice: NoHazardous: No
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CAT#:0804-HY-D0632Size:1 Each
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Description
Pigment Red 147 is a commonly used commercial dye for bulk coloring of plastics and synthetic fibers and for surface coatings such as paints and inks.
CAS Number
68227-78-1
UNSPSC
12171500
Hazard Statement
H312-H341-H351
Target
Fluorescent Dye
Type
Dye Reagents
Related Pathways
Others
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/pigment-red-147.html
Solubility
10 mM in DMSO
Smiles
O=C(C1=CC=C(C(/N=N/C2=C(C(C(NC3=CC(Cl)=CC=C3C)=O)=CC4=C2C=CC=C4)O)=C1)OC)NC5=CC=CC=C5
Molecular Formula
C32H25ClN4O4
Molecular Weight
565.02
Precautions
P280-P302+P352-P362+P364-P405-P501
References & Citations
[1]Curry C J, Rendle D F, Rogers A. Pigment analysis in the forensic examination of paints. I. Pigment analysis by x-ray powder diffraction[J]. Journal of the Forensic Science Society, 1982, 22 (2) : 173-177.
Shipping Conditions
Room temperature
Scientific Category
Dye Reagents
Clinical Information
No Development Reported

Chemical Information

2-Naphthalenecarboxamide, N-(5-chloro-2-methylphenyl)-3-hydroxy-4-[2-[2-methoxy-5-[(phenylamino)carbonyl]phenyl]diazenyl]-
CAS Number68227-78-1
PubChem CID109852
IUPAC NameN-(5-chloro-2-methylphenyl)-3-hydroxy-4-[[2-methoxy-5-(phenylcarbamoyl)phenyl]diazenyl]naphthalene-2-carboxamide
Molecular FormulaC32H25ClN4O4
Molecular Weight565.0
XLogP7.8
Topological Polar Surface Area112
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Heavy Atom Count41
Formal Charge0
Complexity914
SMILES
CC1=C(C=C(C=C1)Cl)NC(=O)C2=CC3=CC=CC=C3C(=C2O)N=NC4=C(C=CC(=C4)C(=O)NC5=CC=CC=C5)OC
InChI
InChI=1S/C32H25ClN4O4/c1-19-12-14-22(33)18-26(19)35-32(40)25-16-20-8-6-7-11-24(20)29(30(25)38)37-36-27-17-21(13-15-28(27)41-2)31(39)34-23-9-4-3-5-10-23/h3-18,38H,1-2H3,(H,34,39)(H,35,40)
InChIKey
WWPCXBSKDSUELS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Naphthalenecarboxamide, N-(5-chloro-2-methylphenyl)-3-hydroxy-4-[2-[2-methoxy-5-[(phenylamino)carbonyl]phenyl]diazenyl]-
CAS: 68227-78-1
CID: 109852
Formula: C32H25ClN4O4
MW: 565.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight565.0
XLogP37.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Exact Mass564.1564330
Monoisotopic Mass564.1564330
Topological Polar Surface Area112 Ų
Heavy Atom Count41
Formal Charge0
Complexity914
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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