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Name	Isonyl	EINECS	207-959-6
CAS No.	503-01-5	Density	0.786g/cm³
PSA	12.03000	LogP	2.73160
Solubility	Practically insol in water. Freely sol in alc, ether, acetone, chloroform	Melting Point	N/A
Formula	C9H19 N	Boiling Point	177.5°Cat760mmHg
Molecular Weight	141.257	Flash Point	46.3°C
Transport Information	N/A	Appearance	Colorless, oily liq
Safety	A poison by ingestion, intravenous, intraperitoneal, and subcutaneous routes. Can cause headache, nausea, and dizziness in humans. When heated to decomposition it emits toxic fumes of NO_x.	Risk Codes	N/A
Molecular Structure		Hazard Symbols	N/A
Synonyms	4-Hexenylamine,N,1,5-trimethyl- (6CI,7CI,8CI); 2-Methyl-6-methylamino-2-heptene;6-Methylamino-2-methylheptene; Isomethepten; Isometheptene; Isonyl; Octanil;Octin; Octine; Octinum; Octon	Article Data	9

Isonyl Chemical Properties

Molecular Structure of Isonyl (CAS NO. 503-01-5):

EINECS: 207-959-6
IUPAC Name: N,6-Dimethylhept-5-en-2-amine
Molecular Formula: C₉H₁₉N
Molecular Weight: 141.253860 g/mol
XLogP3-AA: 2.5
H-Bond Donor: 1
H-Bond Acceptor: 1
Canonical SMILES: CC(CCC=C(C)C)NC
InChI: InChI=1S/C9H19N/c1-8(2)6-5-7-9(3)10-4/h6,9-10H,5,7H2,1-4H3
InChIKey: XVQUOJBERHHONY-UHFFFAOYSA-N
Index of Refraction: 1.438
Molar Refractivity: 47.19 cm³
Molar Volume: 179.7 cm³
Surface Tension: 24.2 dyne/cm
Density: 0.786 g/cm³
Flash Point: 46.3 °C
Enthalpy of Vaporization: 41.38 kJ/mol
Boiling Point: 177.5 °C at 760 mmHg
Vapour Pressure: 1.04 mmHg at 25 °C
BRN of Isonyl (CAS NO. 503-01-5): 1742093

Isonyl Toxicity Data With Reference

1.	orl-mus LD50:134 mg/kg	JPETAB Journal of Pharmacology and Experimental Therapeutics. 116 (1956),377.
2.	ipr-mus LD50:42 mg/kg	JPETAB Journal of Pharmacology and Experimental Therapeutics. 116 (1956),377.
3.	scu-mus LD50:100 mg/kg	FDMU** Zur Pharmakologie des Octins, Adolf Fiegenbaum Dissertation .(Pharmakologischen Institut der Westfalischen Wilhelms-Universitat,Munster, Germany.: 1935,)
4.	ivn-rbt LDLo:50 mg/kg	FDMU** Zur Pharmakologie des Octins, Adolf Fiegenbaum Dissertation .(Pharmakologischen Institut der Westfalischen Wilhelms-Universitat,Munster, Germany.: 1935,)

Isonyl Consensus Reports

Reported in EPA TSCA Inventory.

Isonyl Safety Profile

A poison by ingestion, intravenous, intraperitoneal, and subcutaneous routes. Can cause headache, nausea, and dizziness in humans. When heated to decomposition it emits toxic fumes of NO_x.

Isonyl Specification

Isonyl with cas registry number of 503-01-5 is also known as 2-Methyl-6-methylamino-2-heptene ; 3-04-00-00467 (Beilstein Handbook Reference) ; 6-Methylamino-2-methylheptene ; 4-Hexenylamine, N,1,5-trimethyl- ; 5-Hepten-2-amine, N,6-dimethyl- ; Isometepteno ; Isometepteno [INN-Spanish] ; Isometheptenum ; Isometheptenum [INN-Latin] ; Isometheptene ; Isometheptene [INN:BAN] ; Methylisooctenylamine ; Methyloctenylamine ; N,1,5-Trimethyl-4-hexenylamine ; N,6-Dimethyl-5-hepten-2-amine ; Octanil ; Octin ; Octinum ; Octon ; UNII-Y7L24THH6T . It is colorless oily liquid with ammonia smell, soluble in ethanol, ethyl ether, acetone and chloroform . It is a strong alkaline and can be volatile with steam.

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