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2-Pentanone, 1,1-diphenyl-1-hydroxy-5-piperidino-

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Name

2-Pentanone, 1,1-diphenyl-1-hydroxy-5-piperidino-

EINECS N/A
CAS No. 24860-78-4 Density 1.11g/cm3
PSA 40.54000 LogP 3.69560
Solubility N/A Melting Point N/A
Formula C22H27NO2 Boiling Point 497.9°Cat760mmHg
Molecular Weight 337.4553 Flash Point 254.9°C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 24860-78-4 (1-Hydroxy-1,1-diphenyl-5-piperidino-2-pentanone) Hazard Symbols N/A
Synonyms

2-Pentanone,1-hydroxy-1,1-diphenyl-5-piperidino- (8CI);1-Hydroxy-1,1-diphenyl-5-piperidino-2-pentanone;1,1-Diphenyl-1-hydroxy-5-piperidino-2-pentanone;

Article Data 1

2-Pentanone, 1,1-diphenyl-1-hydroxy-5-piperidino- Chemical Properties

Molecular Structure of 2-Pentanone, 1,1-diphenyl-1-hydroxy-5-piperidino- (CAS NO.24860-78-4):

IUPAC Name: 1-Hydroxy-1,1-diphenyl-5-piperidin-1-ylpentan-2-one
Canonical SMILES: C1CCN(CC1)CCCC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O
InChI: InChI=1S/C22H27NO2/c24-21(15-10-18-23-16-8-3-9-17-23)22(25,19-11-4-1-5-12-19)20-13-6-2-7-14-20/h1-2,4-7,11-14,25H,3,8-10,15-18H2
InChIKey: VRMXLTBRJQANCL-UHFFFAOYSA-N
Molecular Weight: 337.45528 [g/mol]
Molecular Formula: C22H27NO2
XLogP3-AA: 3.6
H-Bond Donor: 1
H-Bond Acceptor: 3 
Index of Refraction: 1.571
Molar Refractivity: 99.87 cm3
Molar Volume: 303.8 cm3
Surface Tension: 46.4 dyne/cm
Density: 1.11 g/cm3
Flash Point: 254.9 °C
Enthalpy of Vaporization: 80.67 kJ/mol
Boiling Point: 497.9 °C at 760 mmHg
Vapour Pressure: 9.82E-11 mmHg at 25 °C
Classification Code: Drug / Therapeutic Agent

2-Pentanone, 1,1-diphenyl-1-hydroxy-5-piperidino- Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 142mg/kg (142mg/kg)   Russian Pharmacology and Toxicology Vol. 32, Pg. 311, 1969.

2-Pentanone, 1,1-diphenyl-1-hydroxy-5-piperidino- Specification

  2-Pentanone, 1,1-diphenyl-1-hydroxy-5-piperidino- (CAS NO.24860-78-4), its Synonyms are 2-Pentanone,1-hydroxy-1,1-diphenyl-5-piperidino- (8CI) ; 1,1-Diphenyl-1-hydroxy-5-piperidino-2-pentanone ; 1-Hydroxy-1,1-diphenyl-5-piperidino-2-pentanone .

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