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Aluminon

CAT: 0931-TXB-00302-03Size: 50 gDry Ice: NoHazardous: No
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CAT#:0931-TXB-00302-03Size:50 g
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CAS Number
569-58-4
Bioactivity
Aluminon (ATA; Ammonium aurintricarboxylate; Aurintricarboxylic acid ammonium) functions as a complexometric titration indicator and also acts as a nuclease inhibitor, impacting transfection. Additionally, Aluminon can be utilized as a biomaterial or organic compound in life science research.
Smiles
O=C(C1=C/C(C=CC1=O)=C(C2=CC=C(C(C([O-])=O)=C2)O)/C3=CC=C(C(C([O-])=O)=C3)O)[O-].[NH4+].[NH4+].[NH4+]
Molecular Formula
C22H23N3O9
Molecular Weight
473.43
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Aluminon
CAS Number569-58-4
PubChem CID13710524
IUPAC Nameazane;5-[(3-carboxy-4-hydroxyphenyl)-(3-carboxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-2-hydroxybenzoic acid
Molecular FormulaC22H23N3O9
Molecular Weight473.4
Topological Polar Surface Area172
Hydrogen Bond Donor Count8
Hydrogen Bond Acceptor Count12
Rotatable Bond Count5
Heavy Atom Count34
Formal Charge0
Complexity841
SMILES
C1=CC(=C(C=C1C(=C2C=CC(=O)C(=C2)C(=O)O)C3=CC(=C(C=C3)O)C(=O)O)C(=O)O)O.N.N.N
InChI
InChI=1S/C22H14O9.3H3N/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);3*1H3
InChIKey
AIPNSHNRCQOTRI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Aluminon
CAS: 569-58-4
CID: 13710524
Formula: C22H23N3O9
MW: 473.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight473.4
Hydrogen Bond Donor Count8
Hydrogen Bond Acceptor Count12
Rotatable Bond Count5
Exact Mass473.14342932
Monoisotopic Mass473.14342932
Topological Polar Surface Area172 Ų
Heavy Atom Count34
Formal Charge0
Complexity841
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count4
Compound Is CanonicalizedYes