Product Name: Flutonidine hydrochloride (CAS NO.16822-88-1)
Molecular Formula: C10H12FN3•ClH
Molecular Weight: 229.71g/mol
Mol File: 16822-88-1.mol
Boiling point: 416.4 °C at 760 mmHg
Flash Point: 205.6 °C
Enthalpy of Vaporization: 66.96 kJ/mol
Vapour Pressure: 3.83E-07 mmHg at 25°C
H-Bond Donor: 2
H-Bond Acceptor: 4
Structure Descriptors of Flutonidine hydrochloride (CAS NO.16822-88-1):
IUPAC Name: 2-(4,5-dihydro-1H-imidazol-1-ium-2-ylmethyl)-4-fluoroaniline chloride
Canonical SMILES: C1CN=C([NH2+]1)CC2=C(C=CC(=C2)F)N.[Cl-]
InChI: InChI=1S/C10H12FN3.ClH/c11-8-1-2-9(12)7(5-8)6-10-13-3-4-14-10;/h1-2,5H,3-4,6,12H2,(H,13,14);1H
InChIKey: PRUPOOUYYCMJKV-UHFFFAOYSA-N
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intravenous | 31mg/kg (31mg/kg) | SENSE ORGANS AND SPECIAL SENSES: OTHER: EYE BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD SKIN AND APPENDAGES (SKIN): HAIR: OTHER | Arzneimittel-Forschung. Drug Research. Vol. 25, Pg. 786, 1975. |
rat | LD50 | intravenous | 47mg/kg (47mg/kg) | LUNGS, THORAX, OR RESPIRATION: ACUTE PULMONARY EDEMA LUNGS, THORAX, OR RESPIRATION: DYSPNEA | Journal of Toxicological Sciences. Vol. 11, Pg. 67, 1986. |
A poison by intravenous route. When heated to decomposition it emits toxic vapors of NOx, HCl, and F−.
Flutonidine hydrochloride , its CAS NO. is 16822-88-1, the synonyms are 2-(2-Methyl-5-fluorophenylamino)-2-imidazoline hydrochloride ; 2-(5-Fluoro-o-toluidino)-2-imidazoline hydrochloride ; St 600-Cl ; 1H-Imidazol-2-amine, 4,5-dihydro-N-(5-fluoro-2-methylphenyl)-, monohydrochloride (9CI) ; 1H-Imidazol-2-amine, N-(5-fluoro-2-methylphenyl)-4,5-dihydro-, monohydrochloride (9CI) ; 2-Imidazoline, 2-(5-fluoro-o-toluidino)-, monohydrochloride .
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