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CAS No.: | 130752-32-8 |
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Name: | FMOC-D-ARG-OH |
Article Data: | 9 |
Molecular Structure: | |
Formula: | C21H24N4O4 |
Molecular Weight: | 396.446 |
Synonyms: | N-|A-Fmoc-D-Arginine; FMOC-D-ARGININE; Fmoc-D-Arg-OH; |
Density: | 1.38 g/cm3 |
PSA: | 137.53000 |
LogP: | 3.82340 |
The FMOC-D-Arg-oh, with CAS registry number 130752-32-8, has the systematic name of N~5~-(diaminomethylidene)-N~2~-[(9H-fluoren-9-ylmethoxy)carbonyl]-L-ornithine. Besides this, it is also called N-α-Fmoc-D-Arginine. This chemical should be stored at the temperature of -15°C. And the chemical formula of this chemical is C21H24N4O4.
Physical properties of FMOC-D-Arg-oh: (1)ACD/LogP: 2.94; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 0.47; (4)ACD/LogD (pH 7.4): 0.44; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 3.23; (8)ACD/KOC (pH 7.4): 2.98; (9)#H bond acceptors: 8; (10)#H bond donors: 6; (11)#Freely Rotating Bonds: 9; (12)Polar Surface Area: 74.68 Å2; (13)Index of Refraction: 1.659; (14)Molar Refractivity: 105.56 cm3; (15)Molar Volume: 286.2 cm3; (16)Polarizability: 41.84×10-24cm3; (17)Surface Tension: 58.2 dyne/cm; (18)Density: 1.38 g/cm3.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)[C@@H](NC(=O)OCC3c1ccccc1c2c3cccc2)CCC/N=C(\N)N
(2)InChI: InChI=1/C21H24N4O4/c22-20(23)24-11-5-10-18(19(26)27)25-21(28)29-12-17-15-8-3-1-6-13(15)14-7-2-4-9-16(14)17/h1-4,6-9,17-18H,5,10-12H2,(H,25,28)(H,26,27)(H4,22,23,24)/t18-/m0/s1
(3)InChIKey: DVBUCBXGDWWXNY-SFHVURJKBB
(4)Std. InChI: InChI=1S/C21H24N4O4/c22-20(23)24-11-5-10-18(19(26)27)25-21(28)29-12-17-15-8-3-1-6-13(15)14-7-2-4-9-16(14)17/h1-4,6-9,17-18H,5,10-12H2,(H,25,28)(H,26,27)(H4,22,23,24)/t18-/m0/s1
(5)Std. InChIKey: DVBUCBXGDWWXNY-SFHVURJKSA-N