CAS No.229180-64-7,FMOC-L-4-PHOSPHONOMETHYLPHENYLALANINE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	229180-64-7
Name:	FMOC-L-4-PHOSPHONOMETHYLPHENYLALANINE
Article Data:	1

Formula:	C₂₅H₂₄NO₇P
Molecular Weight:	481.442
Synonyms:	Fmoc-4-(phosphonomethyl)-Phe-OH; (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[4-(phosphonomethyl)phenyl]propanoic acid;
Density:	1.42 g/cm³
PSA:	142.97000
LogP:	4.28960

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Specification

The L-Phenylalanine,N-[(9H-fluoren-9-ylmethoxy)carbonyl]-4-(phosphonomethyl)- is an organic compound with the formula C₂₅H₂₄NO₇P. The systematic name of this chemical is N-[(9H-fluoren-9-ylmethoxy)carbonyl]-4-(phosphonomethyl)-L-phenylalanine. With the CAS registry number 229180-64-7, it is also named as Fmoc-4-(phosphonomethyl)-L-phenylalanine. The product's categories are Unusual Amino Acids; Amino Acids.

Physical properties about L-Phenylalanine,N-[(9H-fluoren-9-ylmethoxy)carbonyl]-4-(phosphonomethyl)- are: (1)ACD/LogP: 2.95; (2)ACD/LogD (pH 5.5): -1.7; (3)ACD/LogD (pH 7.4): -1.95; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 8; (9)#H bond donors: 4; (10)#Freely Rotating Bonds: 9; (11)Polar Surface Area: 101.18 Å²; (12)Index of Refraction: 1.647; (13)Molar Refractivity: 123.26 cm³; (14)Molar Volume: 338.8 cm³; (15)Polarizability: 48.86×10^-24cm³; (16)Surface Tension: 68.9 dyne/cm; (17)Density: 1.42 g/cm³.

You can still convert the following datas into molecular structure:
(1)SMILES: O=P(O)(O)Cc1ccc(cc1)C[C@@H](C(=O)O)NC(=O)OCC4c2ccccc2c3c4cccc3
(2)InChI: InChI=1/C25H24NO7P/c27-24(28)23(13-16-9-11-17(12-10-16)15-34(30,31)32)26-25(29)33-14-22-20-7-3-1-5-18(20)19-6-2-4-8-21(19)22/h1-12,22-23H,13-15H2,(H,26,29)(H,27,28)(H2,30,31,32)/t23-/m0/s1
(3)InChIKey: OBRYXGOVBZKHLL-QHCPKHFHBY
(4)Std. InChI: InChI=1S/C25H24NO7P/c27-24(28)23(13-16-9-11-17(12-10-16)15-34(30,31)32)26-25(29)33-14-22-20-7-3-1-5-18(20)19-6-2-4-8-21(19)22/h1-12,22-23H,13-15H2,(H,26,29)(H,27,28)(H2,30,31,32)/t23-/m0/s1
(5)Std. InChIKey: OBRYXGOVBZKHLL-QHCPKHFHSA-N