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CAS No.: | 143-85-1 |
---|---|
Name: | 2-chloro-1-{1-[hydroxy(diphenyl)methyl]piperidin-4-yl}ethanone |
Article Data: | 3 |
Molecular Structure: | |
Formula: | C20H22 Cl N O2 |
Molecular Weight: | 343.853 |
Synonyms: | 4-Piperidinemethanol,1-(chloroacetyl)-a,a-diphenyl- (6CI,7CI,8CI,9CI) |
Density: | 1.228g/cm3 |
Boiling Point: | 479°Cat760mmHg |
Flash Point: | 243.5°C |
Safety: | A poison by intraperitoneal route. A flammable liquid. When heated to decomposition it emits toxic vapors of NOx and Cl−. |
PSA: | 40.54000 |
LogP: | 3.33780 |
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Molecular Structure of 1-Chloroacetyl-α-α-diphenyl-4-piperidinemethanol (CAS NO.143-85-1):
IUPAC: 2-Chloro-1-[1-(hydroxy-diphenyl-methyl)-4-piperidyl]ethanone
Molecular Formula:C20H22ClNO2
Density:1.228 g/cm3
Flash Point:243.5oC
Boiling Point:479oC at 760 mmHg
SMILES:ClCC(=O)C3CCN(C(O)(c1ccccc1)c2ccccc2)CC3
InChI:InChI=1/C20H22ClNO2/c21-15-19(23)16-11-13-22(14-12-16)20(24,17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-10,16,24H,11-15H2
InChIKey:OXKRHUJDYNUUBQ-UHFFFAOYAE
Index of Refraction:1.596
Molar Volume:279.9 cm3
Surface Tension:51.6 dyne/cm
Molar Refractivity:95.35 cm3
Enthalpy of Vaporization:78.29 kJ/mol
Vapour Pressure:5.51E-10 mmHg at 25oC
1. | ipr-mus LD50:20 mg/kg | JPMSAE Journal of Pharmaceutical Sciences. 55 (1966),529. |
A poison by intraperitoneal route. A flammable liquid. When heated to decomposition it emits toxic vapors of NOx and Cl−.
DOT Classification: 3; Label: Flammable Liquid
1-Chloroacetyl-α-α-diphenyl-4-piperidinemethanol with cas registry number of 143-85-1 is also known as 4-Piperidinemethanol,1-chloroacetyl-alpha,alpha-diphenyl- ; Ketone,chloromethyl 4-(diphenylhydroxymethyl)piperidino . This compound should be stored in a cool, dry place when not in use. 1-Chloroacetyl-α-α-diphenyl-4-piperidinemethanol with cas registry number of 143-85-1 is used as an anti-cancer agent. It also used as a pharmaceutical intermediate.