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160751-44-0
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Basic Information
CAS No.: 160751-44-0
Name: N-ALFA-FMOC-4-(PHOSPHONODIFLUOROMETHYL)-L-PHENYLALANINE
Article Data: 2
Molecular Structure:
Molecular Structure of 160751-44-0 (N-ALFA-FMOC-4-(PHOSPHONODIFLUOROMETHYL)-L-PHENYLALANINE)
Formula: C25H22F2NO7P
Molecular Weight: 517.423
Synonyms: 4-[(DITHYLPHOSPHONO)DIFLUOROMETHYL]-N-(FLUOREN-9-YLMETHOXYCARBONYL)-L-PHENYLALAMINE; Fmoc-4-(phosphonodifluoromethyl)phenylalanine; (S)-2-{[(9H-fluoren-9-yl)methoxy]carbonylamino}-3-{4-[difluoro(phosphono)methyl]phenyl}propanoic acid; 4-(DIETHYLPHOSPHONO)DIFLUOROMETHYL)-N-(FLUOREN-9-YL-METHOXYCARBONY)-L-PHENYLALANINE; 4-(DIFLUOROPHOSPHONOMETHYL)-N-[(9H-FLUOREN-9-YLMETHOXY)CARBONYL]-L-PHENYLALANINE; N-ALFA-FLUORENYLCARBONYL-4-(DIETHYLPHOSPHONODIFLUOROMETHYL)-L-PHENYLALANINE; Fmoc-F2Pmp-OH; (4-(DIETHYLPHOSPHONO)DIFLUOROMETHYL)-N-(FLUOREN-9-YL-METHOXYCARBONYL)-L-PHENYLALANINE; 查看更多英文别名 收起
Density: 1.476 g/cm3
Boiling Point: 721.4oC at 760mmHg
Flash Point: 390.1oC
PSA: 142.97000
LogP: 4.83890
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Specification

The L-Phenylalanine,4-(difluorophosphonomethyl)-N-[(9H-fluoren-9-ylmethoxy)carbonyl]- is an organic compound with the formula C25H22F2NO7P. The systematic name of this chemical is 4-[Difluoro(phosphono)methyl]-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-L-phenylalanine. With the CAS registry number 160751-44-0, it is also named as (4-(Diethylphosphono)difluoromethyl)-N-(fluoren-9-yl-methoxycarbonyl)-L-phenylalanine. Besides, its molecular weight is 517.42.

Physical properties about L-Phenylalanine,4-(difluorophosphonomethyl)-N-[(9H-fluoren-9-ylmethoxy)carbonyl]- are: (1)ACD/LogP: 3.79; (2)# of Rule of 5 Violations: 1; (3)#H bond acceptors: 8; (4)#H bond donors: 4; (5)#Freely Rotating Bonds: 9; (6)Polar Surface Area: 142.97 Å2; (7)Index of Refraction: 1.62; (8)Molar Refractivity: 123.161 cm3; (9)Molar Volume: 350.648 cm3; (10)Polarizability: 48.825×10-24 cm3; (11)Surface Tension: 62.907 dyne/cm; (12)Density: 1.476 g/cm3.

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C25H22F2NO7P/c26-25(27,36(32,33)34)16-11-9-15(10-12-16)13-22(23(29)30)28-24(31)35-14-21-19-7-3-1-5-17(19)18-6-2-4-8-20(18)21/h1-12,21-22H,13-14H2,(H,28,31)(H,29,30)(H2,32,33,34)/t22-/m0/s1
(2)InChIKey: XKWYQNFAGUNPJV-QFIPXVFZBR
(3)Std. InChI: InChI=1S/C25H22F2NO7P/c26-25(27,36(32,33)34)16-11-9-15(10-12-16)13-22(23(29)30)28-24(31)35-14-21-19-7-3-1-5-17(19)18-6-2-4-8-20(18)21/h1-12,21-22H,13-14H2,(H,28,31)(H,29,30)(H2,32,33,34)/t22-/m0/s1
(4)Std. InChIKey: XKWYQNFAGUNPJV-QFIPXVFZSA-N