Cas no 4431-00-9 (Aurintricarboxylic acid)
Aurintricarboxylic acid structure
Product Name:Aurintricarboxylic acid
CAS No:4431-00-9
MF:C22H14O9
MW:422.341166973114
MDL:MFCD00011663
CID:85042
PubChem ID:2259
Update Time:2025-04-18
Aurintricarboxylic acid Chemical and Physical Properties
Names and Identifiers
-
- Aurintricarboxylic acid
- 5,5-(3-carboxy-4-oxocyclohexa-2,5-dienylidenemethylene)di(salicylic acid)
- aurinetricarboxylic acid
- ATA
- aluminon free acid
- DTXSID9063453
- HMS3260K09
- Aluminon
- SPECTRUM1505163
- chrome violet CG free acid
- NCGC00015040-05
- NCGC00015040-08
- 5-[(3-carboxy-4-hydroxyphenyl)-(3-carboxy-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-2-hydroxybenzoic acid
- CHEBI:87397
- Dupont DA 639 (SD-095345)
- Aurintricarboxylic acid, practical grade, >=85% (titration), powder
- 5-[(3-carboxy-4-hydroxy-phenyl)-(3-carboxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]-2-hydroxy-benzoic acid
- MFCD00011663
- 3,3'-[(3-Carboxy-4-oxo-2,5-cyclohexadien-1-ylidene)methylene]bis[6-hydroxybenzoic acid]
- aurin tricarboxylic acid
- NSC643698
- EN300-226544
- NSC4056
- NCGC00015040-02
- NCGC00260739-01
- 1,4-Cyclohexadiene-1-carboxylic acid, 3-[bis(3-carboxy-4-hydroxyphenyl)methylene]-6-oxo-
- 5-[(3-carboxy-4-hydroxyphenyl)(3-carboxy-4-oxocyclohexa-2,5-dienylidene)methyl ]-2-hydroxybenzoic acid
- Aurintricarboxylicacid(ATA)
- CCG-204149
- NCGC00015040-03
- SR-01000075661-1
- 5-[(3-carboxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-(3-carboxy-4-oxidanyl-phenyl)methyl]-2-oxidanyl-benzoic acid
- 5,5'-(3-Carboxy-4-oxocyclohexa-2,5-dienylidenemethylene)di(salicylic acid)
- CP 005240
- 1,4-Cyclohexadiene-1-carboxylic acid, 3-(bis(3-carboxy-4-hydroxyphenyl)methylene)-6-oxo-
- NCGC00096052-01
- NCGC00015040-06
- AT15393
- MS-27411
- Lopac0_000054
- GIXWDMTZECRIJT-UHFFFAOYSA-N
- NCGC00015040-04
- 3,3'-[(3-carboxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylene]bis(6-hydroxybenzoic acid)
- UNII-NP9O8E29QW
- NCGC00015040-01
- Benzoic acid, 3,3'-((3-carboxy-4-oxo-2,5-cyclohexadien-1-ylidene)methylene)bis(6-hydroxy-
- SR-01000075661
- EU-0100054
- HY-122575
- SR-01000075661-7
- Benzoic acid, 5-[(3-carboxy-4-hydroxyphenyl) (3-carboxy-4-oxo-2,5-cyclohexadien-1-ylidene)methyl]-2-hydroxy-
- 5-[(3-carboxy-4-hydroxyphenyl)-(3-carboxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-2-hydroxybenzoic acid
- NS00031410
- 3,3'-((3-CARBOXY-4-OXO-2,5-CYCLOHEXADIEN-1-YLIDENE)METHYLENE)BIS(6-HYDROXYBENZOIC ACID)
- Dupont ATA
- Benzoic acid, 5-((3-carboxy-4-hydroxyphenyl)(3-carboxy-4-oxo-2,5-cyclohexadien-1-ylidene)methyl)-2-hydroxy-
- Benzoic acid, 5-[(3-carboxy-4-hydroxyphenyl)(3-carboxy-4-oxo-2,5-cyclohexadien-1-ylidene)methyl]-2-hydroxy-
- AMY25154
- SDCCGSBI-0050042.P002
- SMR000326731
- LP00054
- Tox21_500054
- CHEMBL275938
- Lopac-A-1895
- 5-[(3-carboxy-4-hydroxy-phenyl)-(3-carboxy-4-keto-cyclohexa-2,5-dien-1-ylidene)methyl]-2-hydroxy-benzoic acid
- aurine tricarboxylic acid
- NCGC00093568-01
- 4-10-00-04161 (Beilstein Handbook Reference)
- BDBM60996
- NSC-4056
- NSC 4056
- AKOS015969706
- NSC4056ATA
- SCHEMBL98495
- FT-0622509
- CAC 1098
- A 1895
- 4431-00-9
- 5,5'-((3-Carboxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylene)bis(2-hydroxybenzoic acid)
- cid_2259
- EINECS 224-628-1
- Aurintricarboxylic Acids (Technical Grade)
- NP9O8E29QW
- BRN 2228904
- CS-0087159
- 5-[(3-carboxy-4-hydroxyphenyl)(3-carboxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-2-hydroxybenzoic acid
- NCGC00096052-02
- MLS002153482
- Q4822390
- DA-61324
-
- MDL： MFCD00011663
- Inchi： 1S/C22H14O9/c23-16-4-1-10(7-13(16)20(26)27)19(11-2-5-17(24)14(8-11)21(28)29)12-3-6-18(25)15(9-12)22(30)31/h1-9,23-24H,(H,26,27)(H,28,29)(H,30,31)
- InChI Key： GIXWDMTZECRIJT-UHFFFAOYSA-N
- SMILES： OC1C=CC(=CC=1C(=O)O)/C(=C1/C=CC(C(C(=O)O)=C/1)=O)/C1C=CC(=C(C(=O)O)C=1)O
- BRN： 2228904
Computed Properties
- Exact Mass: 422.06400
- Monoisotopic Mass: 422.064
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 5
- Hydrogen Bond Acceptor Count: 9
- Heavy Atom Count: 31
- Rotatable Bond Count: 5
- Complexity: 841
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: 15
- XLogP3: 4.3
- Topological Polar Surface Area: 169A^2
Experimental Properties
- Color/Form: Orange red to brownish red powder
- Density: 1.3860 (rough estimate)
- Melting Point: 300?°C (lit.)
- Boiling Point: 458.99°C (rough estimate)
- Flash Point: 427.1±29.4 °C
- Refractive Index: 1.6230 (estimate)
- Solubility: 1? M NH4OH: 10?mg/mL
- Water Partition Coefficient: Insoluble in water.
- PSA: 169.43000
- LogP: 2.44600
- Solubility: Soluble in water, slightly soluble in ethanol, insoluble in acetone
- Vapor Pressure: 0.0±2.7 mmHg at 25°C
Aurintricarboxylic acid Security Information
- Signal Word：warning
- Hazard Statement： H303+H313+H333
- Warning Statement： P264+P280+P305+P351+P338+P337+P313
- Hazardous Material transportation number：NONH for all modes of transport
- WGK Germany：3
- Hazard Category Code： 36/37/38
- Safety Instruction： S26-S36
- RTECS：GU4790000
-
Hazardous Material Identification：
- TSCA：Yes
- Safety Term：S24/25
- Risk Phrases：R36/37/38
- Storage Condition：storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years)
Aurintricarboxylic acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| MedChemExpress | HY-122575-10mM*1mLinDMSO |
Aurintricarboxylic acid |
4431-00-9 | ≥92.0% | 10mM*1mLinDMSO |
￥610 | 2023-07-26 | |
| MedChemExpress | HY-122575-100mg |
Aurintricarboxylic acid |
4431-00-9 | ≥92.0% | 100mg |
￥550 | 2025-04-16 | |
| Alichem | A019098718-10g |
5,5'-((3-Carboxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylene)bis(2-hydroxybenzoic acid) |
4431-00-9 | 85% | 10g |
$151.50 | 2023-09-01 | |
| Alichem | A019098718-25g |
5,5'-((3-Carboxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylene)bis(2-hydroxybenzoic acid) |
4431-00-9 | 85% | 25g |
$304.50 | 2023-09-01 | |
| ChemScence | CS-0087159-100mg |
Aurintricarboxylic acid |
4431-00-9 | 100mg |
$55.0 | 2022-04-27 | ||
| TRC | A794803-100mg |
Aurintricarboxylic Acids (Technical Grade) |
4431-00-9 | 100mg |
$ 65.00 | 2023-04-19 | ||
| TRC | A794803-5g |
Aurintricarboxylic Acids (Technical Grade) |
4431-00-9 | 5g |
$ 127.00 | 2023-04-19 | ||
| TRC | A794803-10g |
Aurintricarboxylic Acids (Technical Grade) |
4431-00-9 | 10g |
$ 173.00 | 2023-04-19 | ||
| SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd. | A914659-5g |
Aurintricarboxylic acid |
4431-00-9 | practical grade, ≥85% (titration), powder | 5g |
￥379.00 | 2022-09-02 | |
| SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd. | A914659-1g |
Aurintricarboxylic acid |
4431-00-9 | practical grade, ≥85% (titration), powder | 1g |
￥120.00 | 2022-09-02 |
Aurintricarboxylic acid Related Literature
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1. Identification of small molecule inhibitors of the Lin28-mediated blockage of pre-let-7g processingHelen L. Lightfoot,Eric A. Miska,Shankar Balasubramanian Org. Biomol. Chem. 2016 14 10208
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Xuejun Li,Mei Xiong,Yufeng Huang,Liangliang Zhang,Shulin Zhao Anal. Methods 2019 11 739
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M. S. Ata,Y. Liu,I. Zhitomirsky RSC Adv. 2014 4 22716
-
Andrei M. Shved,Petr A. Zhmurov,Evgenii I. Gutsul,Dmitry S. Perekalin New J. Chem. 2020 44 18157
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Xiangyu Cao,Yonglin He,Dan Liu,Yin He,Xiao Hou,Ye Cheng,Jianli Liu RSC Adv. 2018 8 25519
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