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Name |
10H-Phenothiazine-2-carbonitrile,10-[3-(dimethylamino)-2-methylpropyl]- |
EINECS | 222-594-2 |
CAS No. | 3546-03-0 | Density | 1.21 g/cm3 |
PSA | 55.57000 | LogP | 4.42368 |
Solubility | N/A | Melting Point |
90-95°C |
Formula | C19H21N3S | Boiling Point | 479 °C at 760 mmHg |
Molecular Weight | 323.462 | Flash Point | 243.5 °C |
Transport Information | N/A | Appearance | N/A |
Safety | 61 | Risk Codes | 50 |
Molecular Structure | Hazard Symbols | Xi,N | |
Synonyms |
Phenothiazine-2-carbonitrile,10-[3-(dimethylamino)-2-methylpropyl]- (6CI,7CI,8CI);10-[3-(Dimethylamino)-2-methylpropyl]phenothiazine-2-carbonitrile;2-Cyano-10-(3-dimethylamino-2-methylpropyl)phenothiazine;7204 R. E.;Ciamatil;Cianatil;Cyamemazin;Cyamemazine;Cyamepromazine;Cyamepromezine;F.I. 6229;Kyamepromazine;R.P. 7204;TH 2602;Tercian; |
Article Data | 6 |
Conditions | Yield |
---|---|
With ferrous(II) sulfate heptahydrate In methanol at 0℃; for 2h; Polonovski reaction; | A 70% B n/a |
10H-phenothiazine-2-carbonitrile
3-(dimethylamino)-2-methylpropylchloride
cyamemazine
Conditions | Yield |
---|---|
(i) NaNH2, toluene, (ii) /BRN= 506000/; Multistep reaction; |
cyamemazine
Conditions | Yield |
---|---|
With copper; potassium carbonate; N,N-dimethyl-formamide at 155℃; |
10H-phenothiazine-2-carbonitrile
cyamemazine
Conditions | Yield |
---|---|
With sodium amide; xylene |
Conditions | Yield |
---|---|
Multi-step reaction with 2 steps 1: quinoline 2: sodium amide; xylene View Scheme |
10H-phenothiazine-2-carboxylic acid
cyamemazine
Conditions | Yield |
---|---|
Multi-step reaction with 3 steps 1: (i) PCl5, benzene, (ii) NH3 2: POCl3 / Heating 3: (i) NaNH2, toluene, (ii) /BRN= 506000/ View Scheme |
Conditions | Yield |
---|---|
Multi-step reaction with 2 steps 1: POCl3 / Heating 2: (i) NaNH2, toluene, (ii) /BRN= 506000/ View Scheme |
Conditions | Yield |
---|---|
Multi-step reaction with 2 steps 1: 3-chloro-benzenecarboperoxoic acid; sodium hydroxide / dichloromethane / 4 h / 0 - 20 °C 2: ferrous(II) sulfate heptahydrate / methanol / 2 h / 0 °C View Scheme |
10-(3-(1,3-dioxoisoindolin-2-yl)-2-methylpropyl)-10H-phenothiazine-2-carbonitrile
cyamemazine
Conditions | Yield |
---|---|
Multi-step reaction with 2 steps 1.1: hydrazine hydrate / ethanol / 4 h / 70 °C / Inert atmosphere 2.1: tetrahydrofuran / 2 h / 70 °C 2.2: 2 h / 0 °C / Reflux View Scheme |
Conditions | Yield |
---|---|
Stage #1: Desmethyl cyamemazine; dimethyl sulfate In tetrahydrofuran at 70℃; for 2h; Stage #2: dimethyl sulfate With sodium hydroxide In tetrahydrofuran; water at 0℃; for 2h; Reflux; |
This chemical is called 10H-Phenothiazine-2-carbonitrile,10-[3-(dimethylamino)-2-methylpropyl]-, and its systematic name is 10-[3-(dimethylamino)-2-methylpropyl]-10H-phenothiazine-2-carbonitrile. With the molecular formula of C19H21N3S, its molecular weight is 323.46. The CAS registry number of this chemical is 3546-03-0.
Other characteristics of the 10H-Phenothiazine-2-carbonitrile,10-[3-(dimethylamino)-2-methylpropyl]- can be summarised as followings: (1)ACD/LogP: 4.62; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.6; (4)ACD/LogD (pH 7.4): 2.73; (5)ACD/BCF (pH 5.5): 1.81; (6)ACD/BCF (pH 7.4): 24.85; (7)ACD/KOC (pH 5.5): 7.36; (8)ACD/KOC (pH 7.4): 101.15; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 55.57 Å2; (13)Index of Refraction: 1.654; (14)Molar Refractivity: 97.51 cm3; (15)Molar Volume: 265.7 cm3; (16)Polarizability: 38.65×10-24cm3; (17)Surface Tension: 58.6 dyne/cm; (18)Density: 1.21 g/cm3; (19)Flash Point: 243.5 °C; (20)Enthalpy of Vaporization: 74.32 kJ/mol; (21)Boiling Point: 479 °C at 760 mmHg; (22)Vapour Pressure: 2.46E-09 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: N#Cc2cc1N(c3c(Sc1cc2)cccc3)CC(C)CN(C)C
2.InChI: InChI=1/C19H21N3S/c1-14(12-21(2)3)13-22-16-6-4-5-7-18(16)23-19-9-8-15(11-20)10-17(19)22/h4-10,14H,12-13H2,1-3H3
3.InChIKey: SLFGIOIONGJGRT-UHFFFAOYAN
The toxicity data is as follows:
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
man | LDLo | oral | 107mg/kg (107mg/kg) | Journal of Analytical Toxicology. Vol. 17, Pg. 386, 1993. |