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Pigment orange 62

CAT: 0931-T87167-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T87167-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
52846-56-7
Target
Others
Related Pathways
Others
Bioactivity
Pigment Orange 62 is a multifunctional dye used in biological experiments to observe and analyze cell structures, track biomolecules, evaluate cell functions, distinguish cell types, detect biomolecules, study tissue pathology, and monitor microorganisms. Its applications range from basic scientific research to clinical diagnostics. Additionally, dyes are employed in traditional fields like textile dyeing and emerging fields such as functional textile processing, food pigments, and dye-sensitized solar cells.
Smiles
N(C(C(N=NC1=CC=C(N(=O)=O)C=C1)C(C)=O)=O)C=2C=C3C(=CC2)NC(=O)N3
Molecular Formula
C17H14N6O5
Molecular Weight
382.33
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Pigment Orange 62
CAS Number52846-56-7
PubChem CID103697
IUPAC Name2-[(4-nitrophenyl)diazenyl]-3-oxo-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)butanamide
Molecular FormulaC17H14N6O5
Molecular Weight382.3
XLogP2
Topological Polar Surface Area158
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Heavy Atom Count28
Formal Charge0
Complexity669
SMILES
CC(=O)C(C(=O)NC1=CC2=C(C=C1)NC(=O)N2)N=NC3=CC=C(C=C3)[N+](=O)[O-]
InChI
InChI=1S/C17H14N6O5/c1-9(24)15(22-21-10-2-5-12(6-3-10)23(27)28)16(25)18-11-4-7-13-14(8-11)20-17(26)19-13/h2-8,15H,1H3,(H,18,25)(H2,19,20,26)
InChIKey
HXXOOSWHCMYQQV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Pigment Orange 62
CAS: 52846-56-7
CID: 103697
Formula: C17H14N6O5
MW: 382.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight382.3
XLogP32
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Exact Mass382.10256757
Monoisotopic Mass382.10256757
Topological Polar Surface Area158 Ų
Heavy Atom Count28
Formal Charge0
Complexity669
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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