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Resorufin

CAT: 0804-HY-123533-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-123533-01Size:5 mg
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Description
Resorufin (NSC 12097) is a highly fluorescent pink dye. Resorufin shows favorable properties such as water solubility, red-shifted absorption/emission signals. Resorufin is used for the detection of ROS/RNS and a second analyte[1][2].
CAS Number
635-78-9
Product Name Alternative
NSC 12097
UNSPSC
12171500
Hazard Statement
H315, H319, H335
Target
Fluorescent Dye; Reactive Oxygen Species (ROS)
Type
Dye Reagents
Related Pathways
Immunology/Inflammation; Metabolic Enzyme/Protease; NF-κB; Others
Field of Research
Cancer
Assay Protocol
https://www.medchemexpress.com/Resorufin.html
Purity
99.0
Solubility
0.5 M NaOH : 4.38 mg/mL (ultrasonic; warming; adjust pH to 13 with 0.5 M NaOH; heat to 60°C) |DMSO : < 1 mg/mL (ultrasonic) |Ethanol : < 1 mg/mL (ultrasonic)
Smiles
O=C1C=CC2=NC3=C(OC2=C1)C=C(C=C3)O
Molecular Formula
C12H7NO3
Molecular Weight
213.19
Precautions
H315, H319, H335
References & Citations
[1]Odyniec ML , et al. 'AND'-based fluorescence scaffold for the detection of ROS/RNS and a second analyte. Chem Commun (Camb) . 2018 Jul 26;54 (61) :8466-8469.|[2]Almammadov T, et al. Resorufin Enters the Photodynamic Therapy Arena: A Monoamine Oxidase Activatable Agent for Selective Cytotoxicity. ACS Med Chem Lett. 2020 Nov 23;11 (12) :2491-2496.
Shipping Conditions
Room Temperature
Storage Conditions
4°C (Powder, protect from light)
Scientific Category
Dye Reagents
Clinical Information
No Development Reported

Chemical Information

Resorufin

Resorufin is a phenoxazine.

CAS Number635-78-9
PubChem CID69462
IUPAC Name7-hydroxyphenoxazin-3-one
Molecular FormulaC12H7NO3
Molecular Weight213.19
XLogP1.1
Topological Polar Surface Area58.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Heavy Atom Count16
Formal Charge0
Complexity422
SMILES
C1=CC2=C(C=C1O)OC3=CC(=O)C=CC3=N2
InChI
InChI=1S/C12H7NO3/c14-7-1-3-9-11(5-7)16-12-6-8(15)2-4-10(12)13-9/h1-6,14H
InChIKey
HSSLDCABUXLXKM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Resorufin
CAS: 635-78-9
CID: 69462
Formula: C12H7NO3
MW: 213.19
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight213.19
XLogP31.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Exact Mass213.042593085
Monoisotopic Mass213.042593085
Topological Polar Surface Area58.9 Ų
Heavy Atom Count16
Formal Charge0
Complexity422
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