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Home > Encyclopedia > 3-Methylflavone-8-carboxylic acid

3-Methylflavone-8-carboxylic acid

3-Methylflavone-8-carboxylic acid structure

3-Methylflavone-8-carboxylic acid 

structure
  • CAS No:

    3468-01-7

  • Formula:

    C17H12O4

  • Chemical Name:

    3-Methylflavone-8-carboxylic acid

  • Synonyms:

    4H-1-Benzopyran-8-carboxylic acid,3-methyl-4-oxo-2-phenyl-;3-Methyl-4-oxo-2-phenyl-4H-1-benzopyran-8-carboxylic acid;3-Methylflavone-8-carboxylic acid;8-Carboxy-3-methylflavone;3-Methyl-4-oxo-2-phenyl-4H-chromene-8-carboxylic acid;3-Methyl-4-oxo-2-phenylchromene-8-carboxylic acid;108978-28-5

  • Categories:

    Analytical Chemistry  >  Standard

Description

White Crystalline Solid


3-methylflavone-8-carboxylic acid is a member of the class of flavones that is flavone substituted at position 3 by a methyl group and at position 8 by a carboxylic acid group. It has a role as an EC 3.1.4.* (phosphoric diester hydrolase) inhibitor. It is a member of flavones and an oxo monocarboxylic acid.

3-Methylflavone-8-carboxylic acid Basic Attributes

280.27

280.27

1433509

222-425-2

O8RCM70C48

DTXSID00188231

2918300090

Characteristics

63.6

3.47

White Crystalline Solid

1.3±0.1 g/cm3

215-220 °C

485.1±45.0 °C at 760 mmHg

183.3±22.2 °C

1.643

Refrigerator

Safety Information

NONH for all modes of transport

36/37/38

26-36

Xi

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, P501

H302

|Warning|H302 (25%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 8 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

3-methylflavone-8-carboxylic acid

3-Methylflavone-8-carboxylic acid Use and Manufacturing

Uses

The main active metabolite of Flavoxate hydrochloride (FX) in human.

Polyketides [PK] -> Flavonoids [PK12] -> Flavones and Flavonols [PK1211]

Computed Properties

Molecular Weight:280.27
XLogP3:3.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:280.07355886
Monoisotopic Mass:280.07355886
Topological Polar Surface Area:63.6
Heavy Atom Count:21
Complexity:473
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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