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Dicoumarol

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Identification
Molecular formula
C19H12O6
CAS number
66-76-2
IUPAC name
5-[3-(2-carboxy-4-oxo-chromen-5-yl)oxy-2-hydroxy-propoxy]-4-oxo-chromene-2-carboxylic acid
State
State

At room temperature, dicoumarol is typically in a solid state, as it is a crystalline compound.

Melting point (Celsius)
287.00
Melting point (Kelvin)
560.00
Boiling point (Celsius)
529.80
Boiling point (Kelvin)
802.90
General information
Molecular weight
336.30g/mol
Molar mass
336.3120g/mol
Density
1.5300g/cm3
Appearence

Dicoumarol is a crystalline solid that is typically white in color. It may appear as a powder or as fine crystals.

Comment on solubility

Solubility of 5-[3-(2-carboxy-4-oxo-chromen-5-yl)oxy-2-hydroxy-propoxy]-4-oxo-chromene-2-carboxylic acid

The solubility of the compound C19H12O6, also known as 5-[3-(2-carboxy-4-oxo-chromen-5-yl)oxy-2-hydroxy-propoxy]-4-oxo-chromene-2-carboxylic acid, is influenced by several factors:

  • Polarity: Due to the presence of multiple hydroxyl (-OH) and carboxylic acid (-COOH) groups, this compound is expected to be polar, which generally enhances solubility in polar solvents like water.
  • Hydrogen Bonding: The functional groups can engage in hydrogen bonding, facilitating solubility in aqueous solutions.
  • Temperature: The solubility can also vary with temperature, often increasing at elevated temperatures due to enhanced molecular motion.
  • pH Level: As with many acids, the solubility might improve at higher pH levels where the carboxylic acid groups can deprotonate and become negatively charged, increasing their solubility in water.

In general, compounds with similar structures often demonstrate moderate to high solubility in various solvents, making them of great interest in both medicinal and chemical applications. However, the exact solubility can be determined through experimental methods or specific studies focusing on this compound.

Interesting facts

Interesting Facts About 5-[3-(2-carboxy-4-oxo-chromen-5-yl)oxy-2-hydroxy-propoxy]-4-oxo-chromene-2-carboxylic Acid

This compound, with a complex structure, relates to the broader class of compounds known as chromenes, which are known for their diverse biological activities and potential medicinal properties. Here are some compelling insights into this intriguing chemical:

  • Antioxidant Properties: Chromenes, including this compound, are noted for their ability to scavenge free radicals, which may help in protecting cells from oxidative stress.
  • Biological Activity: Research indicates that compounds of this nature may exhibit various pharmacological effects, including anti-inflammatory, antiviral, and anticancer activities.
  • Structure-Activity Relationship: The presence of carboxylic acid groups in the structure greatly enhances solubility and bioactivity, making it a fascinating subject for drug design.

Applications in Research

The unique configuration of this compound opens doors for extensive research, particularly in:

  • Drug formulation, due to its potential therapeutic benefits.
  • Biochemical studies aimed at understanding the interaction of similar compounds within biological systems.

Quote from Scientists:

As one researcher aptly put it, “The beauty of chemistry lies in its ability to create compounds that can alter biological pathways.” This compound epitomizes that beauty, offering numerous avenues for exploration in medicinal chemistry.

In summary, the compound 5-[3-(2-carboxy-4-oxo-chromen-5-yl)oxy-2-hydroxy-propoxy]-4-oxo-chromene-2-carboxylic acid serves as a testament to the rich potential held within the world of organic compounds, making it an exciting area for ongoing and future research.

Synonyms
cromolyn
Cromoglicic acid
16110-51-3
Cromoglycic acid
Cromoglycate
Cromoglicate
Acido cromoglicico
Acide cromoglicique
Acidum cromoglicicum
5,5'-((2-Hydroxypropane-1,3-diyl)bis(oxy))bis(4-oxo-4H-chromene-2-carboxylic acid)
Intal
Cromo-Comod
UNII-Y0TK0FS77W
Y0TK0FS77W
Aarane
5-[3-(2-carboxy-4-oxochromen-5-yl)oxy-2-hydroxypropoxy]-4-oxochromene-2-carboxylic acid
CHEBI:59773
HSDB 3308
Acide cromoglicique [INN-French]
Acido cromoglicico [INN-Spanish]
Acidum cromoglicicum [INN-Latin]
EINECS 240-279-8
1,3-Bis(2-carboxychromon-5-yloxy)-2-hydroxypropane
DTXSID4022860
R03BC01
Aararre
Frenasma
Lomudal
Lomudas
Lomusol
Nalcrom
Nebulasma
Rynacrom
Nasmil
1,3-Di(2-carboxy-4-oxochromen-5-yloxy)propan-2-ol
Cromo asma aerosol
Cromoglicic acid (INN)
Dinatrium cromoglicicum
4H-1-Benzopyran-2-carboxylic acid, 5,5'-((2-hydroxy-1,3-propanediyl)bis(oxy))bis(4-oxo-
CROMOGLICIC ACID [INN]
Acide cromoglicique (INN-French)
Acido cromoglicico (INN-Spanish)
Acidum cromoglicicum (INN-Latin)
4H-1-Benzopyran-2-carboxylic acid, 5,5'-[(2-hydroxy-1,3-propanediyl)bis(oxy)]bis[4-oxo-
5,5'-((2-Hydroxypropane-1,3-diyl)bis(oxy))-bis(4-oxo-4H-chromene-2-carboxylic acid)
5,5'-((2-HYDROXYTRIMETHYLENE)DIOXY)BIS(4-OXO-4H-1-BENZOPYRAN-2-CARBOXYLATE)
5,5'-[(2-hydroxypropane-1,3-diyl)bis(oxy)]bis(4-oxo-4H-chromene-2-carboxylic acid)
FPL 670
4H-1-BENZOPYRAN-2-CARBOXYLIC ACID, 5,5'-((2-HYDROXY-1,3-PROPANEDIYL)BIS(OXY))BIS(4-OXO-)
5-[3-(2-carboxy-4-oxo-4H-5-chromenyloxy)-2-hydroxypropoxy]-4-oxo-4H-2-chromenecarboxylic acid
5-{3-[(2-carboxy-4-oxo-4H-chromen-5-yl)oxy]-2-hydroxypropoxy}-4-oxo-4H-chromene-2-carboxylic acid
Sodium Chromoglycate
5,5'-(2-Hydroxytrimethylenedioxy)bis(4-oxochromene-2-carboxylic acid)
NSC109500
NCGC00021142-02
Chromoglycate
Chromolyn
Cromoglicic acid [INN:BAN]
cromoglicic-acid
Acid, Cromoglicic
Acid, Cromoglycic
5-(3-((2-Carboxy-4-oxo-4H-chromen-5-yl)oxy)-2-hydroxypropoxy)-4-oxo-4H-chromene-2-carboxylic acid
5-(3-(2-carboxy-4-oxo-4H-5-chromenyloxy)-2-hydroxypropoxy)-4-oxo-4H-2-chromenecarboxylic acid
Cromo-Comod (TN)
Cromoglicic acid D5
MFCD00864784
Spectrum_000852
CROMOLYN [HSDB]
CROMOLYN [MI]
CROMOLYN [VANDF]
Cromolyn;Cromoglicic acid
Prestwick0_000812
Prestwick1_000812
Prestwick2_000812
Prestwick3_000812
Spectrum2_001137
Spectrum3_000367
Spectrum4_000302
Spectrum5_000791
SCHEMBL3865
Oprea1_077850
BSPBio_000703
BSPBio_002093
KBioGR_000884
KBioSS_001332
BIDD:GT0397
DivK1c_000857
SPBio_001033
SPBio_002624
BPBio1_000775
CHEMBL428880
DTXCID602860
GTPL7608
KBio1_000857
KBio2_001332
KBio2_003900
KBio2_006468
KBio3_001313
CROMOGLICIC ACID [WHO-DD]
NINDS_000857
HY-B1619
BDBM50440033
AKOS015961001
DB01003
4H-1-Benzopyran-2-carboxylic acid, 5,5'-((2-hydroxytrimethylene)dioxy)bis(4-oxo-
IDI1_000857
NCGC00021142-01
NCGC00159523-01
AC-12785
BS-51003
FC171543
NCI60_000229
SBI-0051323.P003
CS-0013552
NS00006731
1,3-bis(2-carboxychromon-5-yloxy)propan-2-ol
C06928
D07753
E78436
1,3-bis-(2-carboxychromon-5-yloxy)propan-2-ol
EN300-19766015
Q416427
BRD-K20920669-304-06-7
BRD-K20920669-304-09-1
BRD-K20920669-304-10-9
4H-1-Benzopyran-2-carboxylic acid, 5, {5'-[(2-hydroxytrimethylene)dioxy]bis(4-oxo-,}
4H-1-Benzopyran-2-carboxylic acid, 5,5'-((2-hydroxy-1,3-propanediyl)bis(oxy))bis(4-oxo)-
5,5'-(2-hydroxypropane-1,3-diyl)bis(oxy)bis(4-oxo-4H-chromene-2-carboxylic acid)
105878-73-7
2140317-08-2
240-279-8
4H-1-Benzopyran-2-carboxylic acid, {5,5'-[(2-hydroxy-1,3-propanediyl)bis(oxy)]bis[4-oxo-,}
5-[3-(2-carboxy-4-oxo-chromen-5-yl)oxy-2-hydroxy-propoxy]-4-oxo-chromene-2-carboxylic acid