7-Chloro-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

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Names

[ CAS No. ]:
86393-33-1

[ Name ]:
7-Chloro-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

[Synonym ]:
7-Chloro-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid
3-Quinolinecarboxylic acid, 7-chloro-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-
T66 BN EVJ DVQ HF IG B- AL3TJ
7-chloro-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid
MFCD00792458
7-Chloro-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
7-Chloro-1-cyclopropyl-6-fluoro-4-oxyhydroquinoline-3-carboxylic acid
EINECS 405-050-0
7-CHLORO-1-CYCLOPROPYL-6-FLUORO-1,4-DIHYDRO-4-OXO-3-QUINOLINE CARBOXYLIC ACID

Chemical & Physical Properties

[ Density]:
1.7±0.1 g/cm3

[ Boiling Point ]:
467.3±45.0 °C at 760 mmHg

[ Melting Point ]:
242-245 °C(lit.)

[ Molecular Formula ]:
C13H9ClFNO3

[ Molecular Weight ]:
281.667

[ Flash Point ]:
236.4±28.7 °C

[ Exact Mass ]:
281.025513

[ PSA ]:
59.30000

[ LogP ]:
2.16

[ Vapour Pressure ]:
0.0±1.2 mmHg at 25°C

[ Index of Refraction ]:
1.683

[ Storage condition ]:
-20°C Freezer

MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
VB1993795
CHEMICAL NAME :
3-Quinolinecarboxylic acid, 1,4-dihydro-7-chloro-1-cyclopropyl-6-fluoro-4-oxo-
CAS REGISTRY NUMBER :
86393-33-1
LAST UPDATED :
199712
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C13-H9-Cl-F-N-O3

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
583 mg/kg
TOXIC EFFECTS :
Skin and Appendages - hair
REFERENCE :
ATDAEI Acute Toxicity Data. Journal of the American College of Toxicology, Part B. (Mary Ann Liebert, Inc., 1651 Third Ave., New York, NY 10128) V.1- 1990- Volume(issue)/page/year: 15(Suppl 1),S96,1996
TYPE OF TEST :
LC50 - Lethal concentration, 50 percent kill
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>677 mg/m3/4H
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
ATDAEI Acute Toxicity Data. Journal of the American College of Toxicology, Part B. (Mary Ann Liebert, Inc., 1651 Third Ave., New York, NY 10128) V.1- 1990- Volume(issue)/page/year: 15(Suppl 1),S96,1996
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>2 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
ATDAEI Acute Toxicity Data. Journal of the American College of Toxicology, Part B. (Mary Ann Liebert, Inc., 1651 Third Ave., New York, NY 10128) V.1- 1990- Volume(issue)/page/year: 15(Suppl 1),S96,1996

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H302-H412

[ Precautionary Statements ]:
P273

[ Hazard Codes ]:
Xn:Harmful;

[ Risk Phrases ]:
R22;R52/53

[ Safety Phrases ]:
S26-S36-S61-S22

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
2

[ RTECS ]:
VB1993795

[ HS Code ]:
2933499090

Synthetic Route

Precursor & DownStream

Precursor

  • 2,4-Dichloro-5-fluorobenzoyl chloride
  • Cyclopropanamine
  • 7-CHLORO-1-CYCLOPROPYL-6-FLUORO-4-OXO-1,4-DIHYDRO-QUINOLINE-3-CARBOXYLIC ACID ETHYL ESTER
  • 3-Quinolinecarboxylic acid, 7-chloro-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-, Methyl ester
  • ethyl 2-(2,4-dichloro-5-fluoro-benzoyl)-3-cyclopropylamino-acrylate
  • (Z)-2-(2,4-DICHLORO-5-FLUORO-BENZOYL)-3-ETHOXY-ACRYLIC ACID ETHYL ESTER
  • Triethyl orthoformate
  • Potassium hydroxide
  • 7-chloro-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid nitrile

DownStream

  • 3-Quinolinecarboxylic acid, 7-chloro-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-, Methyl ester
  • Enrofloxacin
  • Ciprofloxacin
  • Ciprofloxacin Hydrochloride
  • 6-(2-aminoethylamino)-7-chloro-1-cyclopropyl-4-oxoquinoline-3-carboxylic acid
  • 6-[(2-aminoethyl)amino]-7-chloro-1-cyclopropyl-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid hydrochloride
  • desethylene ciprofloxacin, hydrochloride
  • 1-cyclopropyl-6-fluoro-4-oxo-7-(3-oxopiperazin-1-yl)quinoline-3-carboxylic acid
  • 7-CHLORO-1-CYCLOPROPYL-6-FLUORO-4-OXO-1,4-DIHYDRO-QUINOLINE-3-CARBOXYLIC ACID ETHYL ESTER
  • 1-cyclopropyl-7-(3,5-dimethylpiperazin-1-yl)-6-fluoro-4-oxoquinoline-3-carboxylic acid

Customs

[ HS Code ]: 2918300090

[ Summary ]:
2918300090 other carboxylic acids with aldehyde or ketone function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:6.5%。General tariff:30.0%

Articles

-Chloro-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxoquinoline-3-carboxylic acid. Song J, et al.

Acta Crystallogr. Sect. E Struct. Rep. Online 60(4) , o503-o504, (2004)


More Articles


Related Compounds

  • 4-Pyridinol, 3-bromo-5-(phenylmethoxy)-
  • 5-Amino-1-methyl-6-oxo-1,6-dihydropyridine-3-carbonitrile
  • 2-[3-(Difluoromethyl)cyclobutyl]ethan-1-amine
  • 2-[2-(3-Bromophenyl)cyclopropyl]propanoic acid
  • 1-(4-Bromo-3-(cyclopropylmethoxy)phenyl)ethanone
  • 2-(4-methoxy-1H-pyrazol-1-yl)acetic acid
  • 4-(2-Fluoro-1-hydroxyethyl)phenol
  • 4-fluoro-1H-indazole-3-carbonitrile
  • 3-Bromo-5-cyclopropylisothiazole
  • 1-(2-bromophenyl)-5-methyl-1H-1,2,3-triazole-4-carbaldehyde
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