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CAS No.: | 147290-11-7 |
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Name: | FMOC-ORN(ALOC)-OH |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C24H26N2O6 |
Molecular Weight: | 438.48 |
Synonyms: | L-Ornithine,N2-[(9H-fluoren-9-ylmethoxy)carbonyl]-N5-[(2-propenyloxy)carbonyl]- (9CI); |
Density: | 1.255 g/cm3 |
Boiling Point: | 683.9 °C at 760 mmHg |
Flash Point: | 367.4 °C |
PSA: | 113.96000 |
LogP: | 4.45250 |
The Fmoc-Orn(Aloc)-Oh is an organic compound with the formula C24H26N2O6. The systematic name of this chemical is N~2~-[(9H-fluoren-9-ylmethoxy)carbonyl]-N~5~-[(prop-2-en-1-yloxy)carbonyl]-L-ornithine. With the CAS registry number 147290-11-7, it is also named as (2S)-2-[(fluoren-9-ylmethoxy)carbonylamino]-5-(prop-2-enyloxycarbonylamino)pentanoic acid. The product's categories are Chiral; Amino Acids. Besides, it should be stored at temperature of 2 - 8 °C.
Physical properties about Fmoc-Orn(Aloc)-Oh are: (1)ACD/LogP: 4.64; (2)ACD/LogD (pH 5.5): 2.58; (3)ACD/LogD (pH 7.4): 1.1; (4)ACD/BCF (pH 5.5): 17.39; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 70.01; (7)ACD/KOC (pH 7.4): 2.29; (8)#H bond acceptors: 8; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 12; (11)Polar Surface Area: 85.38 Å2; (12)Index of Refraction: 1.583; (13)Molar Refractivity: 116.8 cm3; (14)Molar Volume: 349.1 cm3; (15)Polarizability: 46.3×10-24cm3; (16)Surface Tension: 53 dyne/cm; (17)Density: 1.255 g/cm3; (18)Flash Point: 367.4 °C; (19)Enthalpy of Vaporization: 105.36 kJ/mol; (20)Boiling Point: 683.9 °C at 760 mmHg; (21)Vapour Pressure: 1.21E-19 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)[C@@H](NC(=O)OCC3c1ccccc1c2c3cccc2)CCCNC(=O)OC\C=C
(2)InChI: InChI=1/C24H26N2O6/c1-2-14-31-23(29)25-13-7-12-21(22(27)28)26-24(30)32-15-20-18-10-5-3-8-16(18)17-9-4-6-11-19(17)20/h2-6,8-11,20-21H,1,7,12-15H2,(H,25,29)(H,26,30)(H,27,28)/t21-/m0/s1
(3)InChIKey: RXLIOYNXBHZZBI-NRFANRHFBP
(4)Std. InChI: InChI=1S/C24H26N2O6/c1-2-14-31-23(29)25-13-7-12-21(22(27)28)26-24(30)32-15-20-18-10-5-3-8-16(18)17-9-4-6-11-19(17)20/h2-6,8-11,20-21H,1,7,12-15H2,(H,25,29)(H,26,30)(H,27,28)/t21-/m0/s1
(5)Std. InChIKey: RXLIOYNXBHZZBI-NRFANRHFSA-N