CAS No.93107-08-5,1-Cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid hydrochloride Suppliers

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Basic Information

Molecular Structure:
CAS No.:	93107-08-5
Name:	1-Cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid hydrochloride
Article Data:	11

Formula:	C₁₇H₁₈FN₃O₃^.HCl
Molecular Weight:	367.808
Synonyms:	3-Quinolinecarboxylic acid, 1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-;1-Cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-7-(1-piperazinyl)-3-;Ciprofloxacin monohydrochloride;
EINECS:	642-985-5
Melting Point:	>300 °C
Boiling Point:	581.8 °C at 760 mmHg
Flash Point:	305.6 °C
Appearance:	white or light yellow crystalline powder
Hazard Symbols:	R36/37/38:;
Risk Codes:	Xi:Irritant; "> Xi:Irritant;
Safety:	24/25
PSA:	74.57000
LogP:	2.77910

Raw Materials

110-85-0

67-68-5

Downstream Products

Total:131 Page 1 of 4 1 2 3 4 Next>>

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Specification

The Ciprofloxacin Hydrochloride, with the CAS registry number 93107-08-5, is also known as 1-Cyclopropyl-6-fluoro-4-oxo-7-(1-piperazinyl)-1,4-dihydro-3-quinolinecarboxylic acid hydrochloride (1:1). This chemical's molecular formula is C₁₇H₁₈FN₃O₃·HCl and molecular weight is 367.80. What's more, both its IUPAC name and systematic name are the same which is called 1-Cyclopropyl-6-fluoro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid hydrochloride.

Physical properties about Ciprofloxacin Hydrochloride are: (1)ACD/LogP: 0.654; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.87; (4)ACD/LogD (pH 7.4): -1.35; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 1.00; (8)ACD/KOC (pH 7.4): 1.00; (9)#H bond acceptors: 6; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 53.09 Å²; (13)Flash Point: 305.6 °C; (14)Enthalpy of Vaporization: 91.5 kJ/mol; (15)Boiling Point: 581.8 °C at 760 mmHg; (16)Vapour Pressure: 2.24E-14 mmHg at 25 °C.

Preparation of Ciprofloxacin Hydrochloride: this chemical can be prepared by Piperazine with 1-Cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxoquinoline-3-carboxylic acid. This reaction needs solvent pyridine at temperature of 105-113 °C. The reaction time is 1 hour. The yield is 78 %.

Ciprofloxacin Hydrochloride can be prepared by Piperazine with 1-Cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxoquinoline-3-carboxylic acid.

You can still convert the following datas into molecular structure:
(1) SMILES: Cl.O=C(O)\C2=C\N(c1cc(c(F)cc1C2=O)N3CCNCC3)C4CC4
(2) InChI: InChI=1S/C17H18FN3O3.ClH/c18-13-7-11-14(8-15(13)20-5-3-19-4-6-20)21(10-1-2-10)9-12(16(11)22)17(23)24;/h7-10,19H,1-6H2,(H,23,24);1H
(3) InChIKey: DIOIOSKKIYDRIQ-UHFFFAOYSA-N

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Source
monkey	LD50	oral	> 5gm/kg (5000mg/kg)	Jitchuken Zenrinsho Kenkyuho. Central Institute for Experimental Animals, Research Reports. Vol. 11, Pg. 411, 1985.
mouse	LD50	intramuscular	258mg/kg (258mg/kg)	Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 19, Pg. 735, 1988.
mouse	LD50	intravenous	258mg/kg (258mg/kg)	Yakkyoku. Pharmacy. Vol. 39, Pg. 1752, 1988.
mouse	LD50	oral	> 5gm/kg (5000mg/kg)	Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 19, Pg. 735, 1988.
rat	LD50	intramuscular	300mg/kg (300mg/kg)	Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 19, Pg. 735, 1988.
rat	LD50	intravenous	300mg/kg (300mg/kg)	Yakkyoku. Pharmacy. Vol. 39, Pg. 1752, 1988.
rat	LD50	oral	> 5gm/kg (5000mg/kg)	Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 19, Pg. 735, 1988.