4,4',4''-Nitrilotribenzoic acid

Basic Information

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CAS Number

118996-38-6

Molecular Formula

C21H15NO6

Molecular Weight

377.35 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Boiling Point

690.0±50.0℃/760mmHg

Solubility

Insuluble (4.2E-3 g/L) (25 ºC),

SMILES

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C1=CC(=CC=C1C(=O)O)N(C2=CC=C(C=C2)C(=O)O)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C21H15NO6/c23-19(24)13-1-7-16(8-2-13)22(17-9-3-14(4-10-17)20(25)26)18-11-5-15(6-12-18)21(27)28/h1-12H,(H,23,24)(H,25,26)(H,27,28)

InChIKey

VEBUOOBGPZWCFE-UHFFFAOYSA-N

LogP

4.251000000000003

Topological Polar Surface Area

115.14 Å²

Hydrogen Bond Donor/Acceptor

3 / 7

Complexity

489

Synonyms & References

English

4,4',4''-nitrilotribenzoic acid
4,4',4''-Nitrilotrisbenzoic acid
4,4',4''-Tricarboxytriphenylamine
[2,2':6',2''-Terpyridine]-4,4',4''-tricarboxylic acid
2,2':6',2''-pyridine-4,4',4''-tricarboxylic acid
4,4',4"-tricarboxy-2,2':6',2"-terpyridine
4,4',4''-tricarboxylic-2,2':6',2''-terpyridyl
4,4',4''-tricarboxyltriphenylamine
4,4',4"-Tricarboxyl triphenylamine
Benzoic acid, 4,4',4''-nitrilotris-
4,4',4''-nitrilotribenzoicacid
ML01007
SY111980
AK543229
4-(4-carboxy-N-(4-carboxyphenyl)anilino)benzoic acid
4,4 inverted exclamation mark ,4 inverted exclamation mark inverted exclamation mark -Nitrilotribenzoic Acid
H3TCA
4,4',4''-nitrilotrisbenzoic acid
SCHEMBL2029621
118996-38-6
YSZC174
tris(4-carboxyphenyl)amine
C21H15NO6
MFCD22123674
DB-228932
CS-W004611
4,4'4 ''-Tricarboxylic acid triphenylamine
DS-19226
4-[BIS(4-CARBOXYPHENYL)AMINO]BENZOIC ACID
4,4,4-nitrilotribenzoic Acid
SB83668

MDL Number

MFCD22123674

FAQ

What is 4,4',4''-Nitrilotribenzoic acid (CAS: 118996-38-6)?

4,4',4''-Nitrilotribenzoic acid (CAS: 118996-38-6) is a trisubstituted aromatic compound with a nitrilotri-bridging group. It is widely used in the synthesis of pharmaceuticals and as a stabilizer in various industries.

What are the main uses of 4,4',4''-Nitrilotribenzoic acid (CAS: 118996-38-6)?

4,4',4''-Nitrilotribenzoic acid (CAS: 118996-38-6) is primarily used as a UV stabilizer in plastics and rubbers, and as a precursor in the synthesis of pharmaceuticals and organic dyes.

Is 4,4',4''-Nitrilotribenzoic acid (CAS: 118996-38-6) safe?

4,4',4''-Nitrilotribenzoic acid (CAS: 118996-38-6) is generally considered safe with appropriate handling. However, it should be used with caution due to its potential for skin and eye irritation. Proper protective equipment and ventilation are recommended.

How should 4,4',4''-Nitrilotribenzoic acid (CAS: 118996-38-6) be stored?

4,4',4''-Nitrilotribenzoic acid (CAS: 118996-38-6) should be stored in tightly sealed containers, protected from light and moisture. It should be kept in a cool, dry place away from heat sources and direct sunlight.