2,4,6-Trihydroxybenzoic acid hydrate (1:1)

Basic Information

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CAS Number

71989-93-0

Molecular Formula

C7H8O6

Molecular Weight

188.14 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Melting Point

210°C(dec.)

Boiling Point

426.5℃ at 760 mmHg

Density

1.7490

Water Solubility

Soluble in water.

Flash Point

225.9°C

SMILES

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C1=C(C=C(C(=C1O)C(=O)O)O)O.O

InChI

InChI=1S/C7H6O5.H2O/c8-3-1-4(9)6(7(11)12)5(10)2-3;/h1-2,8-10H,(H,11,12);1H2

InChIKey

HWZIRFCGHAROOI-UHFFFAOYSA-N

LogP

-0.3230999999999997

Topological Polar Surface Area

129.49 Å²

Hydrogen Bond Donor/Acceptor

6 / 6

Complexity

169

Safety Information

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GHS Hazard Pictograms

H315

H319

H335

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

2,4,6-trihydroxybenzoicacidhydrate
2,4,6-Trihydroxybenzoic Acid Monohydrate
H10169
Benzoic acid, 2,4,6-trihydroxy-, monohydrate
GS-3666
2,4,6-TRIHYDROXYBENZOICACIDMONOHYDRATE
2,4,6-trihydroxybenzoic acid hydrate
AKOS005259190
SY012982
SCHEMBL1285656
CS-W016825
2,4,6-Trihydroxybenzoic acid monohydrate, technical, >=90% (T)
2,4,6-trihydroxybenzoic acid;hydrate
FT-0696144
2,4,6-Trihydroxybenzoic acid monohydrate, technical grade, 90%, predominantly 1,3,5-benzenetriol
2,4,6-Trihydroxybenzoic acid monohydrate
71989-93-0
MFCD00149095
DTXSID80369102
2,4,6-Trihydroxybenzoic acid hydrate
2,4,6-Trihydroxybenzoic Acid Monohydrate
Benzoic acid,2,4,6-trihydroxy-, hydrate (1:1)
Phloroglucinolcarboxylic Acid Monohydrate
2,4,6-trihydroxybenzoate
Phloroglucinolcarboxylic acid
PubChem20337
LS11468
2,4,6-trihydroxybenzoic acid, hydrate
ST2415722
AX8066

MDL Number

MFCD00002453

Customs Code

2918290000

FAQ

What regulatory guidelines apply to 2,4,6-Trihydroxybenzoic acid hydrate (1:1) (CAS: 71989-93-0)?

2,4,6-Trihydroxybenzoic acid hydrate (1:1) (CAS: 71989-93-0) is regulated under GHS (Globally Harmonized System of Classification and Labeling of Chemicals), REACH (Registration, Evaluation, Authorization, and Restriction of Chemicals) in the EU, and FDA and EPA in the USA. Manufacturers and importers must ensure compliance with these regulations, including proper labeling and documentation.

Are there alternatives to 2,4,6-Trihydroxybenzoic acid hydrate (1:1) (CAS: 71989-93-0) in synthesis?

There are several alternatives to 2,4,6-Trihydroxybenzoic acid hydrate (1:1) (CAS: 71989-93-0) in synthesis, such as other benzoic acid derivatives like 4-hydroxybenzoic acid or their hydrates. These alternatives may offer similar properties but with different functional groups, making them suitable for specific applications in research and industry.

What is the market or research trend for 2,4,6-Trihydroxybenzoic acid hydrate (1:1) (CAS: 71989-93-0)?

The market for 2,4,6-Trihydroxybenzoic acid hydrate (1:1) (CAS: 71989-93-0) is experiencing steady growth, driven by its use in pharmaceuticals and fine chemicals. Research trends indicate increasing interest in its application in drug discovery and development, as well as its potential in sustainable materials and cosmetics.

How should waste containing 2,4,6-Trihydroxybenzoic acid hydrate (1:1) (CAS: 71989-93-0) be handled?

Waste containing 2,4,6-Trihydroxybenzoic acid hydrate (1:1) (CAS: 71989-93-0) should be collected in appropriate containers and disposed of through professional waste disposal services. Incineration is a common method, but it must be done in compliance with local environmental regulations. Proper labeling and documentation are required to ensure safe and compliant disposal.