Oxolinic Acid | CAS No. 14698-29-4

Oxolinic Acid

Basic Information

CAS Number

14698-29-4

Molecular Formula

C13H11NO5

Molecular Weight

261.23 g/mol

AD

Basic Physical Properties

Melting Point

314-316°C

Boiling Point

473℃

Flash Point

>110°(230°F)

Solubility

Soluble in 0.5N NaOH with warming

Refractive Index

1.5500 (estimate)

CCN1C=C(C(=O)C2=CC3=C(C=C21)OCO3)C(=O)O

InChI

InChI=1S/C13H11NO5/c1-2-14-5-8(13(16)17)12(15)7-3-10-11(4-9(7)14)19-6-18-10/h3-5H,2,6H2,1H3,(H,16,17)

InChIKey

KYGZCKSPAKDVKC-UHFFFAOYSA-N

LogP

1.4483000000000001

Topological Polar Surface Area

77.76 Ų

Hydrogen Bond Donor/Acceptor

1 / 6

Complexity

446

Safety Information

View Safety Information

GHS Hazard Pictograms

H302H302

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

Toxicity

LD50 in mice, rats (mg/kg): >6000, >2000 orally (Turner)

Synonyms & References

English

  • NCGC00015762-13
  • Lopac0_000952
  • AS-12087
  • 1.4-Dihydro-1-ethyl-6,7-methylenedioxy-4-oxoquinoline-3-carboxylic acid
  • oxolinic-acid
  • Acid, Oxolinic
  • Aqualinic (TN)
  • AC8065
  • Oxolinic acid [USAN:INN:BAN]
  • Tox21_110216
  • HMS2092P09
  • SR-01000076042-6
  • Spectrum3_001490
  • Acidum oxolinicum [INN-Latin]
  • NSC110364
  • BRD-K73394555-001-08-6
  • Acido oxolinico (INN-Spanish)
  • Uritrate
  • Acide oxolinique (INN-French)
  • AKOS000282622
  • InChI=1/C13H11NO5/c1-2-14-5-8(13(16)17)12(15)7-3-10-11(4-9(7)14)19-6-18-10/h3-5H,2,6H2,1H3,(H,16,17
  • D02301
  • 5-Ethyl-8-oxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinoline-7-carboxylic acid
  • Spectrum_001397
  • UNII-L0A22B22FT
  • Uro-alvar
  • L0A22B22FT
  • Lopac-O-0877
  • Pharmakon1600-01502030
  • 1,5-g]quinoline-7-carboxylic acid, 5-ethyl-5,8-dihydro-8-oxo-
  • 5-Ethy1-5,8-dihydro-8-oxo-1,3-dioxolo[4,5]quinoline-7-carboxylic acid

MDL Number

MFCD00056775

Customs Code

2934999090

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