2,4,6-Trihydroxybenzoic acid
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2,4,6-Trihydroxybenzoic acid
structure -
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CAS No:
83-30-7
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Formula:
C7H6O5
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Chemical Name:
2,4,6-Trihydroxybenzoic acid
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Synonyms:
Benzoic acid,2,4,6-trihydroxy-;2,4,6-Trihydroxybenzoic acid;2,4,6-Trihydroxybenzenecarboxylic acid;Phloroglucinolcarboxylic acid;Phloroglucinic acid;NSC 36720;4,6-Dihydroxysalicylic acid
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CAS No:
2,4,6-Trihydroxybenzoic acid Basic Attributes
170.12
170.12
201-467-5
3NC0UQ5EMR
36720
DTXSID1058890
2918290000
Characteristics
98
1.8
Solid
1.7±0.1 g/cm3
160-161 °C
426.5°C at 760 mmHg
225.9±21.1 °C
1.730
1.868e+004 mg/L @ 25 °C (est)
Store in a cool, dry place. Store in a tightly closed container.
Safety Information
3
36/37/38
22-24/25-26-37/39
DH8910000
Xi
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501
H315
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
2,4,6-Trihydroxybenzoic acid Use and Manufacturing
2,4,6-Trihydroxybenzoic Acid is a metabolite of Naringin (N378980), a major flavonoid found in grapefruit juice and was shown to exhibit properties as an antioxidant, lipid lowering and anticancer activities.
Benzoic acid, 2,4,6-trihydroxy-: ACTIVE
Computed Properties
Molecular Weight:170.12
XLogP3:1.8
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:170.02152329
Monoisotopic Mass:170.02152329
Topological Polar Surface Area:98
Heavy Atom Count:12
Complexity:169
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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