The store will not work correctly when cookies are disabled.
JavaScript seems to be disabled in your browser.
For the best experience on our site, be sure to turn on Javascript in your browser.
This is a demo store. No orders will be fulfilled.
We use cookies to keep things working smoothly and to improve your experience.
Choose what’s okay for you below. See our Cookie Policy .
Accept Cookies
Chromeazurol S indicator - 0.02%, high purity , CAS No.1667-99-8
Basic Description
Synonyms
Chrome Azurol S | Mordant Blue 29 | 1667-99-8 | Chromeazurol S | C.I. Mordant Blue 29 | Antracromo Azurol BS | Chromine Sky Blue S | Y6C592EY5D | Chromoxane Pure Blue BLD | Chrome Azurol | C.I. 43825 | 2,6-Dichlorodimethyl-sulfoxy-fuchsonedicarboxylic Acid Sodium Salt | Benzoic
Specifications & Purity
0.02%
Shipped In
Normal
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Diphenylmethanes
Intermediate Tree Nodes
Not available
Direct Parent
Diphenylmethanes
Alternative Parents
Aromatic monoterpenoids Benzenesulfonic acids and derivatives Salicylic acids Monocyclic monoterpenoids 1-sulfo,2-unsubstituted aromatic compounds Benzenesulfonyl compounds Benzoic acids P-quinomethanes Ortho cresols Benzoyl derivatives Dichlorobenzenes Toluenes Aryl chlorides Organosulfonic acids Sulfonyls Vinylogous acids Carboxylic acid salts Monocarboxylic acids and derivatives Carboxylic acids Organic metal halides Hydrocarbon derivatives Organic oxides Organic sodium salts Organochlorides Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Diphenylmethane - Aromatic monoterpenoid - Salicylic acid - Salicylic acid or derivatives - Benzenesulfonate - Monoterpenoid - Monocyclic monoterpenoid - Hydroxybenzoic acid - Arylsulfonic acid or derivatives - Benzoic acid or derivatives - Benzenesulfonyl group - 1-sulfo,2-unsubstituted aromatic compound - Benzoic acid - Quinomethane - P-quinomethane - O-cresol - Benzoyl - 1,3-dichlorobenzene - Chlorobenzene - Halobenzene - Toluene - Phenol - Aryl chloride - Aryl halide - Sulfonyl - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Vinylogous acid - Cyclic ketone - Ketone - Carboxylic acid salt - Organic metal halide - Monocarboxylic acid or derivatives - Organic alkali metal salt - Carboxylic acid derivative - Carboxylic acid - Organosulfur compound - Organooxygen compound - Organic sodium salt - Organic oxygen compound - Carbonyl group - Organic salt - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organochloride - Organic cation - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as diphenylmethanes. These are compounds containing a diphenylmethane moiety, which consists of a methane wherein two hydrogen atoms are replaced by two phenyl groups.
External Descriptors
Not available
Data sources
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
Associated Targets(Human)
Associated Targets(non-human)
Mechanisms of Action
Mechanism of Action
Action Type
target ID
Target Name
Target Type
Target Organism
Binding Site Name
References
Names and Identifiers
IUPAC Name
trisodium;5-[(E)-(3-carboxy-5-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)-(2,6-dichloro-3-sulfonatophenyl)methyl]-3-methyl-2-oxidobenzoate
INCHI
InChI=1S/C23H16Cl2O9S.3Na/c1-9-5-11(7-13(20(9)26)22(28)29)17(12-6-10(2)21(27)14(8-12)23(30)31)18-15(24)3-4-16(19(18)25)35(32,33)34;;;/h3-8,26H,1-2H3,(H,28,29)(H,30,31)(H,32,33,34);;;/q;3*+1/p-3/b17-12+;;;
InChIKey
FUIZKNBTOOKONL-DPSBJRLESA-K
Smiles
CC1=CC(=CC(=C1[O-])C(=O)[O-])C(=C2C=C(C(=O)C(=C2)C(=O)O)C)C3=C(C=CC(=C3Cl)S(=O)(=O)[O-])Cl.[Na+].[Na+].[Na+]
Isomeric SMILES
CC1=CC(=CC(=C1[O-])C(=O)[O-])/C(=C\2/C=C(C(=O)C(=C2)C(=O)O)C)/C3=C(C=CC(=C3Cl)S(=O)(=O)[O-])Cl.[Na+].[Na+].[Na+]
PubChem CID
54694372
Molecular Weight
605.28
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Molecular Weight
605.300 g/mol
XLogP3
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
9
Rotatable Bond Count
3
Exact Mass
603.935 Da
Monoisotopic Mass
603.935 Da
Topological Polar Surface Area
183.000 Ų
Heavy Atom Count
38
Formal Charge
0
Complexity
1100.000
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
1
Undefined Bond Stereocenter Count
0
The total count of all stereochemical bonds
1
Covalently-Bonded Unit Count
4
Citations of This Product
1.
Xiaoqing Lv, Zhengtai Ma, Jiaqi Xu, Zhen Wang, Guixian Zhu, Beiju Huang.
(2023)
A novel paper-based colorimetric sensor using parylene C for Al (III) detection on a smartphone platform. MICROCHEMICAL JOURNAL,
195
(109369).
2.
Shan Sun, Sihua Qian, Jianping Zheng, Zhongjun Li, Hengwei Lin.
(2020)
A colorimetric sensor array for the discrimination of Chinese liquors. ANALYST,
145
(21):
(6968-6973).
3.
Li Fang, Hu Yuting, Li Zimu, Liu Jiachang, Guo Lei, He Jianbo.
(2019)
Three-dimensional microfluidic paper-based device for multiplexed colorimetric detection of six metal ions combined with use of a smartphone. ANALYTICAL AND BIOANALYTICAL CHEMISTRY,
411
(24):
(6497-6508).
4.
Tongxiang Song, Huijie Liu, Tengteng Lv, Xuelin Zhao, Yina Shao, Qingxi Han, Chenghua Li, Weiwei Zhang.
(2018)
Characteristics of the iron uptake-related process of a pathogenic Vibrio splendidus strain associated with massive mortalities of the sea cucumber Apostichopus japonicus. JOURNAL OF INVERTEBRATE PATHOLOGY,
155
(25).
Solution Calculators
Molarity Calculator
Determine the necessary mass, volume, or concentration for preparing a solution.
Dilution Calculator
Determine the dilution needed to prepare a stock solution.
Reconstitution Calculator
Shall we send you a message when we have discounts available?
Remind me later
Allow
Thank you! Please check your email inbox to confirm.
Oops! Notifications are disabled.
4 Citations
F2118009