1-Ethyl-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylic acid | CAS No. 389-08-2

1-Ethyl-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylic acid

Basic Information

CAS Number

389-08-2

Molecular Formula

C12H12N2O3

Molecular Weight

232.24 g/mol

AD

Basic Physical Properties

Melting Point

227-229 °C

Boiling Point

413.1°C at 760 mmHg

Water Solubility

0.1 g/L (23 ºC)

Flash Point

203.6 °C

Solubility

chloroform: 20 mg/mL, clear

Refractive Index

1.6660 (estimate)

Vapor Pressure

0.0±1.0 mmHg at 25°C

CCN1C=C(C(=O)C2=C1N=C(C=C2)C)C(=O)O

InChI

InChI=1S/C12H12N2O3/c1-3-14-6-9(12(16)17)10(15)8-5-4-7(2)13-11(8)14/h4-6H,3H2,1-2H3,(H,16,17)

InChIKey

MHWLWQUZZRMNGJ-UHFFFAOYSA-N

LogP

1.4230200000000002

Topological Polar Surface Area

72.19 Ų

Hydrogen Bond Donor/Acceptor

1 / 5

Complexity

378

Safety Information

View Safety Information

GHS Hazard Pictograms

H334H334

Hazard Statement

H334 May cause allergy or asthma symptoms or breathing difficulties if inhaled
Sensitization, respiratory

Toxicity

LD50 in mice (mg/kg): 3300 orally; 500 s.c.; 176 i.v. (Lesher, 1962)

Synonyms & References

English

  • Nalidixan
  • C05079
  • NCGC00018181-01
  • DB00779
  • BB 0242389
  • NS00009829
  • 1-Ethyl-1,4-dihydro-7-methyl-4-oxo-1,8-naphthyridine-3-carboxylic acid
  • Nalidixic acid, European Pharmacopoeia (EP) Reference Standard
  • WLN: T66 BN EV JNJ B2 DVQ I1
  • KBioGR_001333
  • Tox21_302754
  • 3-Carboxy-1-ethyl-7-methyl-1,8-naphthidin-4-one
  • KBio2_001398
  • 3-Carboxy-1-ethyl-7-methyl-1,8-naphthyridin-4-one
  • EINECS 206-864-7
  • Tox21_110835
  • SR-01000003086-6
  • SY049448
  • Nalix
  • DTXCID70912
  • Nicelate
  • NALIDIXIC ACID (USP IMPURITY)
  • S2328
  • Spectrum4_000817
  • HMS2092K04
  • NCIOpen2_004342
  • HMS3374G11
  • Acidum nalidixicum (INN-Latin)
  • CHEBI:100147
  • BPBio1_000125
  • Nalidixic acid (NegGram)

MDL Number

MFCD00006884

Customs Code

2933990090

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