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Flavopiridol

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Name

Flavopiridol

EINECS N/A
CAS No. 146426-40-6 Density 1.448 g/cm3
PSA 94.14000 LogP 3.24250
Solubility N/A Melting Point 52.5 °C
Formula C21H20ClNO5 Boiling Point 603.6 °C at 760 mmHg
Molecular Weight 401.847 Flash Point 318.8 °C
Transport Information N/A Appearance Yellow powder
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 146426-40-6 (Flavopiridol) Hazard Symbols N/A
Synonyms

4H-1-Benzopyran-4-one,2-(2-chlorophenyl)-5,7-dihydroxy-8-(3-hydroxy-1-methyl-4-piperidinyl)-,cis-(-)-;Alvocidib;HMR 1275;L 86-8275;

Article Data 4

Flavopiridol Chemical Properties

IUPAC Name: 2-(2-chlorophenyl)-5,7-dihydroxy-8-[(3S,4R)-3-hydroxy-1-methylpiperidin-4-yl]chromen-4-one 
Empirical Formula: C21H20ClNO5
Molecular Weight: 401.8402g/mol
Structure of 4H-1-Benzopyran-4-one,2-(2-chlorophenyl)-5,7-dihydroxy-8-[(3S,4R)-3-hydroxy-1-methyl-4-piperidinyl]- (CAS NO.146426-40-6):

Index of Refraction: 1.673
Molar Refractivity: 103.98 cm3
Molar Volume: 277.3 cm3
Polarizability: 41.22×10-24cm3
Surface Tension: 66.4 dyne/cm
Density: 1.448 g/cm3
Flash Point: 318.8 °C
Enthalpy of Vaporization: 94.4 kJ/mol
Boiling Point: 603.6 °C at 760 mmHg
Vapour Pressure: 2.03E-15 mmHg at 25°C 
Product Categories: API intermediates 
Canonical SMILES: CN1CCC(C(C1)O)C2=C(C=C(C3=C2OC(=CC3=O)C4=CC=CC=C4Cl)O)O
Isomeric SMILES: CN1CC[C@@H]([C@@H](C1)O)C2=C(C=C(C3=C2OC(=CC3=O)C4=CC=CC=C4Cl)O)O
InChI: InChI=1S/C21H20ClNO5/c1-23-7-6-12(17(27)10-23)19-14(24)8-15(25)20-16(26)9-18(28-21(19)20)11-4-2-3-5-13(11)22/h2-5,8-9,12,17,24-25,27H,6-7,10H2,1H3/t12-,17+/m0/s1
InChIKey: BIIVYFLTOXDAOV-YVEFUNNKSA-N

Flavopiridol Specification

  4H-1-Benzopyran-4-one,2-(2-chlorophenyl)-5,7-dihydroxy-8-[(3S,4R)-3-hydroxy-1-methyl-4-piperidinyl]- , its cas register number is 146426-40-6. It also can be called (-)cis-5,7-Dihydroxy-2-(2-chlorophenyl)-8-(4-(3-hydroxy-1-
methyl)piperidinyl)-4H-1-benzopyran-4-one ; Alvocidib ; L-868275 ; UNII-45AD6X575G ; Flavopiridol .

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