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L-Glutamic acid,N-[4-[1-[(2,4-diamino-6-pteridinyl)methyl]-3-butyn-1-yl]benzoyl]- (146464-95-1)

Identification
Name:L-Glutamic acid,N-[4-[1-[(2,4-diamino-6-pteridinyl)methyl]-3-butyn-1-yl]benzoyl]-
Synonyms:L-Glutamicacid, N-[4-[1-[(2,4-diamino-6-pteridinyl)methyl]-3-butynyl]benzoyl]- (9CI);10-Propargyl-10-deazaaminopterin; PDX; Pralatrexate
CAS:146464-95-1
Molecular Formula: C23H23 N7 O5
Molecular Weight: 477.4726
InChI: InChI=1/C23H23N7O5/c1-2-3-14(10-15-11-26-20-18(27-15)19(24)29-23(25)30-20)12-4-6-13(7-5-12)21(33)28-16(22(34)35)8-9-17(31)32/h1,4-7,11,14,16H,3,8-10H2,(H,28,33)(H,31,32)(H,34,35)(H4,24,25,26,29,30)/t14?,16-/m0/s1
Molecular Structure: (C23H23N7O5) L-Glutamicacid, N-[4-[1-[(2,4-diamino-6-pteridinyl)methyl]-3-butynyl]benzoyl]- (9CI);10-Propargyl-10...
Properties
Flash Point: °C
Boiling Point: °Cat760mmHg
Density:1.471g/cm3
Refractive index:1.703
Solubility:Practically insoluble in shloroform and ethanol
Soluble in aqueous solutions at pH 6.5 or higher
In water, 360 mg/L at 25 deg C (est)
Flash Point: °C
Color: Off-white to yellow solid
Safety Data
 

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