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1-ethyl-4-oxo-[1,3]dioxolo[4,5-g]cinnoline-3-carboxylic acid

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Identification
Molecular formula
C13H9N3O5
CAS number
19300-78-6
IUPAC name
1-ethyl-4-oxo-[1,3]dioxolo[4,5-g]cinnoline-3-carboxylic acid
State
State

This compound is a solid at room temperature.

Melting point (Celsius)
262.00
Melting point (Kelvin)
535.20
Boiling point (Celsius)
458.50
Boiling point (Kelvin)
731.70
General information
Molecular weight
273.23g/mol
Molar mass
273.2270g/mol
Density
1.4123g/cm3
Appearence

This compound typically appears as a pale yellow or off-white crystalline powder. It may exhibit a slight odor. The crystals are fine and can be somewhat powdery to coarse.

Comment on solubility

Solubility of 1-ethyl-4-oxo-[1,3]dioxolo[4,5-g]cinnoline-3-carboxylic acid

The solubility of 1-ethyl-4-oxo-[1,3]dioxolo[4,5-g]cinnoline-3-carboxylic acid, with the molecular formula C13H9N3O5, presents some interesting characteristics worth noting. This compound, containing both carboxylic acid and dioxole functional groups, indicates potential variability in its solubility. Here are some critical insights:

  • Polar vs. Nonpolar Behavior: The presence of the carboxylic acid group likely enhances the polarity of the molecule, suggesting increased solubility in polar solvents such as water.
  • Hydrogen Bonding: The ability to form hydrogen bonds with water molecules further supports the hypothesis of good solubility in aqueous solutions.
  • Organic Solvents: In addition to water, this compound may also show solubility in various organic solvents, although the degree may vary based on the solvent’s polarity.
  • pH Influence: The solubility might also be pH-dependent, as the ionization of the carboxylic acid could lead to increased solubility at higher pH levels.

In summary, while precise solubility data can further elucidate these hypotheses, it is reasonable to posit that 1-ethyl-4-oxo-[1,3]dioxolo[4,5-g]cinnoline-3-carboxylic acid exhibits substantial solubility in various polar solvents due to its functional groups and structural characteristics.

Interesting facts

Interesting Facts about 1-ethyl-4-oxo-[1,3]dioxolo[4,5-g]cinnoline-3-carboxylic acid

1-ethyl-4-oxo-[1,3]dioxolo[4,5-g]cinnoline-3-carboxylic acid is a fascinating compound that stands out due to its complex structure and diverse applications. Here are some notable facts:

  • Pharmaceutical Interest: Compounds with similar structures have been researched for potential therapeutic applications, particularly in the development of new drugs targeting various diseases.
  • Origin of Name: The name reflects its intricate molecular architecture, including the dioxolo moiety, which is indicative of its unique ring structure that can influence its chemical behavior.
  • Reactivity: The carboxylic acid functional group present in the compound makes it an interesting candidate for chemical reactions, especially in organic synthesis and modification processes.
  • Scientific Curiosity: Chemists are often intrigued by the cinnoline base due to its aromatic properties, which can lead to various derivatives and potential applications in materials science.
  • Environmental Relevance: Research is ongoing to understand the environmental behaviors of such compounds, which can play roles in biogeochemical cycles or as intermediates in chemical reactions within ecosystems.

In summary, 1-ethyl-4-oxo-[1,3]dioxolo[4,5-g]cinnoline-3-carboxylic acid exemplifies the intricate relationships between molecular structure and function, making it a compound of interest in both academic and applied chemistry fields. Its various potential uses are a testament to the ongoing exploration in the realm of organic compounds.

Synonyms
cinoxacin
28657-80-9
Cinobac
Cinoxacino
Cinoxacine
Cinoxacinum
Compound 64716
Cinobactin
Uronorm
Lilly 64716
Cinx
Cinoxacine [INN-French]
Cinoxacinum [INN-Latin]
Cinoxacino [INN-Spanish]
1-Ethyl-6,7-methylenedioxy-4(1H)-oxocinnoline-3-carboxylic acid
NSC 304467
[1,3]Dioxolo[4,5-g]cinnoline-3-carboxylic acid, 1-ethyl-1,4-dihydro-4-oxo-
UNII-LMK22VUH23
EINECS 249-133-8
LMK22VUH23
NSC-304467
BRN 1084304
CCRIS 8206
CHEBI:3716
MLS000069630
1-ethyl-4-oxo-[1,3]dioxolo[4,5-g]cinnoline-3-carboxylic acid
DTXSID8022822
1-Ethyl-1,4-dihydro-4-oxo(1,3)dioxolo(4,5-g)cinnoline-3-carboxylic acid
1-Ethyl-1,4-dihydro-4-oxo[1,3]dioxolo[4,5-g]cinnoline-3-carboxylic acid
SMR000058232
DTXCID202822
Clinoxacin
Azolinic Acid
(1,3)Dioxolo(4,5-g)cinnoline-3-carboxylic acid, 1,4-dihydro-1-ethyl-4-oxo-
(1,3)Dioxolo(4,5-g)cinnoline-3-carboxylic acid, 1-ethyl-1,4-dihydro-4-oxo-
1-Ethyl-4-oxo-1,4-dihydro[1,3]dioxolo[4,5-g]cinnoline-3-carboxylic acid
NSC304467
Cinoxacin [USAN:USP:INN:BAN:JAN]
NCGC00015277-02
CAS-28657-80-9
Cinoxacine (INN-French)
Cinoxacinum (INN-Latin)
Cinoxacino (INN-Spanish)
CINOXACIN (MART.)
CINOXACIN [MART.]
1-Ethyl-4-oxo-1,4-dihydro-[1,3]dioxolo[4,5-g]cinnoline-3-carboxylic acid
1-ethyl-4-oxo-1H,4H,7H-[1,3]dioxolo[4,5-g]cinnoline-3-carboxylic acid
CINOXACIN (USP IMPURITY)
CINOXACIN [USP IMPURITY]
Acid, Azolinic
Cinoxacin (USAN:USP:INN:BAN:JAN)
(1,3)DIOXOLO(4,5-G)CINNOLINE-3-CARBOXYLIC ACID, 1-ETHYL-1,4-DIHYDRO-4-OXO
Cinobac (TN)
SR-01000000129
cinoxacina
Noxigram
1-ethyl-4-oxo-1,4-dihydro(1,3)dioxolo(4,5-g)cinnoline-3-carboxylic acid
5-Ethyl-8-oxo-5,8-dihydro-1,3-dioxa-5,6-diaza-cyclopenta(b)naphthalene-7-carboxylic acid
5-Ethyl-8-oxo-5,8-dihydro-1,3-dioxa-5,6-diaza-cyclopenta[b]naphthalene-7-carboxylic acid
TNP00246
Prestwick_239
MFCD00056776
Spectrum_000152
CINOXACIN [INN]
CINOXACIN [JAN]
CINOXACIN [MI]
CINOXACIN [USAN]
Opera_ID_1392
Prestwick0_000780
Prestwick1_000780
Prestwick2_000780
Prestwick3_000780
Spectrum2_000570
Spectrum3_000352
Spectrum4_000289
Spectrum5_000749
CINOXACIN [VANDF]
Lopac-C-8645
C 8645
cid_2762
CINOXACIN [WHO-DD]
CHEMBL1208
Lopac0_000309
Oprea1_131085
SCHEMBL43770
BSPBio_000860
BSPBio_002043
KBioGR_000818
KBioSS_000632
MLS001148076
DivK1c_000318
SPECTRUM1500190
SPBio_000360
SPBio_002799
Cinoxacin (JP18/USP/INN)
BPBio1_000946
CINOXACIN [ORANGE BOOK]
BDBM39350
GTPL12401
HMS500P20
KBio1_000318
KBio2_000632
KBio2_003200
KBio2_005768
KBio3_001263
J01MB06
NINDS_000318
HMS1570K22
HMS1920O11
HMS2091E18
HMS2097K22
HMS2235K07
HMS3260N20
HMS3370B19
HMS3714K22
Pharmakon1600-01500190
HY-B1085
Tox21_110121
Tox21_500309
CCG-39160
NSC756695
1-ethyl-4-oxohydro-7H-1,3-dioxoleno[4,5-g]cinnoline-3-carboxylic acid
AKOS022507372
Tox21_110121_1
CS-4652
DB00827
FC72005
LP00309
NSC-756695
SDCCGSBI-0050297.P005
IDI1_000318
NCGC00015277-01
NCGC00015277-03
NCGC00015277-04
NCGC00015277-05
NCGC00015277-06
NCGC00015277-07
NCGC00015277-08
NCGC00015277-09
NCGC00015277-10
NCGC00015277-11
NCGC00015277-12
NCGC00015277-13
NCGC00015277-14
NCGC00015277-17
NCGC00015277-21
NCGC00023754-03
NCGC00023754-04
NCGC00023754-05
NCGC00023754-06
NCGC00023754-07
NCGC00260994-01
AS-73151
SBI-0050297.P004
DB-047427
EU-0100309
NS00006827
SW196546-3
A12385
C08052
D00872
EN300-267813
AB00051948_17
AB00051948_18
A819523
Q1639588
SR-01000000129-2
SR-01000000129-4
SR-01000000129-7
BRD-K14704277-001-05-1
BRD-K14704277-001-15-0
BRD-K14704277-001-22-6
BRD-K14704277-001-23-4
1-Ethyl-1,3]dioxolo[4,5-g]cinnoline-3-carboxylic acid
Z2065671138
[1,5-g]cinnoline-3-carboxylic acid, 1-ethyl-1,4-dihydro-4-oxo-
1-Ethyl-1,4-dihydro-4-oxo(1,3)dioxolo(4,5-g)cinnoline-3-carboxylicacid
1-ethyl-1,4-dihydro-4-oxo-[1,3]dioxolo[4,5-g]cinnoline-3-carboxylic acid
1-ethyl-4-oxidanylidene-[1,3]dioxolo[4,5-g]cinnoline-3-carboxylic acid
5-Ethyl-8-oxo-5,8-dihydro(1,3)dioxolo(4,5-g)cinnoline-7-carboxylic acid
1-Ethyl-1,4-Dihydro-4-oxo (1,3) Dioxolo (4,5-g) Cinnoline-3-Carboxylic Acid
249-133-8