Phloroglucinol carboxylic acid

Names

[ CAS No. ]:
83-30-7

[ Name ]:
Phloroglucinol carboxylic acid

[Synonym ]:
Phloroglucinic acid
Phloroglucinol carboxylic acid
Phloroglucinolcarboxylic acid
2,4,6-Trihydroxybenzoic acid
Benzoic acid, 2,4,6-trihydroxy-
EINECS 201-467-5
MFCD00002453

Biological Activity

[Description]:

2,4,6-Trihydroxybenzoic acid, the flavonoid metabolite, is a CDK inhibitor. 2,4,6-Trihydroxybenzoic acid can be used for the research of cancer[1].

[Related Catalog]:

Research Areas >> Cancer

Signaling Pathways >> Cell Cycle/DNA Damage >> CDK

[References]

[1]. Sankaranarayanan R, et, al. The Flavonoid Metabolite 2,4,6-Trihydroxybenzoic Acid Is a CDK Inhibitor and an Anti-Proliferative Agent: A Potential Role in Cancer Prevention. Cancers (Basel). 2019 Mar 26;11(3):427.

Chemical & Physical Properties

[ Density]:
1.7±0.1 g/cm3

[ Boiling Point ]:
426.5±30.0 °C at 760 mmHg

[ Melting Point ]:
~210 °C (dec.)

[ Molecular Formula ]:
C₇H₆O₅

[ Molecular Weight ]:
170.120

[ Flash Point ]:
225.9±21.1 °C

[ Exact Mass ]:
170.021530

[ PSA ]:
97.99000

[ LogP ]:
1.80

[ Vapour Pressure ]:
0.0±1.1 mmHg at 25°C

[ Index of Refraction ]:
1.730

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: DH8910000

CHEMICAL NAME :: Benzoic acid, 2,4,6-trihydroxy-

CAS REGISTRY NUMBER :: 83-30-7

BEILSTEIN REFERENCE NO. :: 2212148

LAST UPDATED :: 199701

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C7-H6-O5

MOLECULAR WEIGHT :: 170.13

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: >800 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 196,478,1976

Safety Information

[ Hazard Codes ]:
Xi

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S22-S24/25-S26-S37/39

[ WGK Germany ]:
3

[ RTECS ]:
DH8910000

[ HS Code ]:
2918290000

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

DownStream

Customs

[ HS Code ]: 2918290000

[ Summary ]:
HS: 2918290000 other carboxylic acids with phenol function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) VAT:17.0% MFN tariff:6.5% General tariff:30.0%