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CAS No.: | 5588-10-3 |
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Name: | Methoxyphenamine hydrochloride |
Article Data: | 1 |
Molecular Structure: | |
Formula: | C11H17NO.HCl |
Molecular Weight: | 215.723 |
Synonyms: | Benzeneethanamine,2-methoxy-N,a-dimethyl-,hydrochloride (9CI);Phenethylamine, o-methoxy-N,a-dimethyl-, hydrochloride (7CI,8CI);2-Methoxymethamphetamine hydrochloride;Methoxyphenaminium chloride;NSC 65644;Orthoxine hydrochloride;Proasma;dl-Orthoxine hydrochloride;dl-o-Methoxy-N,a-dimethylphenethylaminehydrochloride;o-Methoxy-N,a-dimethylphenethylamine hydrochloride; |
EINECS: | 226-993-2 |
Density: | 0.951 g/cm3 |
Melting Point: | 210°C |
Boiling Point: | 252.3 °C at 760 mmHg |
Flash Point: | 102.6 °C |
Hazard Symbols: | Xn |
Risk Codes: | 22 |
Safety: | 36 |
PSA: | 21.26000 |
LogP: | 3.03850 |
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The CAS register number of 1-(2-Methoxyphenyl)-N-methylpropan-1-amine hydrochloride is 5588-10-3. It also can be called as Methoxyphenamine hydrochloride and the systematic name about this chemical is 1-(2-methoxyphenyl)-N-methylpropan-2-amine hydrochloride. The molecular formula about this chemical is C11H17NO.HCl and the molecular weight is 215.72. Classification code about this chemical is Drug / Therapeutic Agent. This chemical is harmful if swallowed. When you are using it, wear suitable protective clothing. This chemical is stable under normal temperature and pressure. If you want to store this chemical, please keep it in a sealed container and store it in a dark, cool and dry place.
Physical properties about 1-(2-Methoxyphenyl)-N-methylpropan-1-amine hydrochloride are: (1)ACD/LogP: 1.86; (2)ACD/LogD (pH 5.5): -1; (3)ACD/LogD (pH 7.4): -1; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 12.47Å2; (12)Flash Point: 102.6 °C; (13)Enthalpy of Vaporization: 48.97 kJ/mol; (14)Boiling Point: 252.3 °C at 760 mmHg; (15)Vapour Pressure: 0.0194 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Cl.O(c1ccccc1CC(NC)C)C
(2)InChI: InChI=1/C11H17NO.ClH/c1-9(12-2)8-10-6-4-5-7-11(10)13-3;/h4-7,9,12H,8H2,1-3H3;1H
(3)InChIKey: FGSJNNQVSUVTPW-UHFFFAOYAP
(4)Std. InChI: InChI=1S/C11H17NO.ClH/c1-9(12-2)8-10-6-4-5-7-11(10)13-3;/h4-7,9,12H,8H2,1-3H3;1H
(5)Std. InChIKey: FGSJNNQVSUVTPW-UHFFFAOYSA-N
The toxicity data is as follows:
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
dog | LD50 | subcutaneous | 241mg/kg (241mg/kg) | Nippon Yakurigaku Zasshi. Japanese Journal of Pharmacology. Vol. 54, Pg. 688, 1958. | |
mouse | LD50 | intraperitoneal | 90mg/kg (90mg/kg) | "Psychotropic Drugs and Related Compounds," 2nd ed., Usdin, E., and D.H. Efron, Washington, DC, 1972Vol. -, Pg. 348, 1972. | |
mouse | LD50 | oral | 605mg/kg (605mg/kg) | BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD BEHAVIORAL: ATAXIA LUNGS, THORAX, OR RESPIRATION: DYSPNEA | Nippon Yakurigaku Zasshi. Japanese Journal of Pharmacology. Vol. 55, Pg. 653, 1959. |
mouse | LD50 | subcutaneous | 380mg/kg (380mg/kg) | BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD LUNGS, THORAX, OR RESPIRATION: DYSPNEA BEHAVIORAL: ATAXIA | Nippon Yakurigaku Zasshi. Japanese Journal of Pharmacology. Vol. 55, Pg. 653, 1959. |
rabbit | LD50 | intravenous | 30mg/kg (30mg/kg) | Drugs in Japan Vol. 6, Pg. 837, 1982. | |
rabbit | LD50 | oral | 652mg/kg (652mg/kg) | Drugs in Japan Vol. 6, Pg. 837, 1982. | |
rabbit | LD50 | subcutaneous | 269mg/kg (269mg/kg) | Drugs in Japan Vol. 6, Pg. 837, 1982. | |
rat | LD50 | intravenous | 50mg/kg (50mg/kg) | Drugs in Japan Vol. 6, Pg. 837, 1982. | |
rat | LD50 | oral | 630mg/kg (630mg/kg) | Drugs in Japan Vol. 6, Pg. 837, 1982. | |
rat | LD50 | subcutaneous | 573mg/kg (573mg/kg) | Drugs in Japan Vol. 6, Pg. 837, 1982. |