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| CAS No.: | 147900-45-6 |
|---|---|
| Name: | Cyclohexanecarboxylicacid, 4-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-, cis- |
| Molecular Structure: | |
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| Formula: | C22H23NO4 |
| Molecular Weight: | 365.42 |
| Synonyms: | trans-4-(Fmoc-amino)cyclohexanecarboxylic acid; |
| Density: | 1.29 g/cm3 |
| Boiling Point: | 596.9 °C at 760 mmHg |
| Flash Point: | 314.8 °C |
| PSA: | 75.63000 |
| LogP: | 4.55940 |
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Specification
The trans-4-(Fmoc-amino)cyclohexanecarboxylic acid with the CAS number 147900-45-6 is also called Cyclohexanecarboxylicacid, 4-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-, cis-. The systematic name is 4-(9H-fluoren-9-ylmethoxycarbonylamino)cyclohexane-1-carboxylic acid. Its molecular formula is C22H23NO4. This chemical belongs to the following product categories: (1)FMOC; (2)Alicyclic Amino Acids; (3)Peptide Synthesis; (4)Unnatural Amino Acid Derivatives.
The properties of the chemical are: (1)ACD/LogP: 4.35; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.63; (4)ACD/LogD (pH 7.4): 1.84; (5)#H bond acceptors: 5; (6)#H bond donors: 2; (7)#Freely Rotating Bonds: 5; (8)Polar Surface Area: 75.63 Å2; (9)Index of Refraction: 1.634; (10)Molar Refractivity: 100.76 cm3; (11)Molar Volume: 281.7 cm3; (12)Polarizability: 39.94×10-24cm3; (13)Surface Tension: 60.3 dyne/cm; (14)Enthalpy of Vaporization: 93.51 kJ/mol; (15)Vapour Pressure: 4.27×10-15 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: OC(=O)[C@@H]1CC[C@H](CC1)NC(=O)OCC4c2ccccc2c3ccccc34
(2)InChI: InChI=1/C22H23NO4/c24-21(25)14-9-11-15(12-10-14)23-22(26)27-13-20-18-7-3-1-5-16(18)17-6-2-4-8-19(17)20/h1-8,14-15,20H,9-13H2,(H,23,26)(H,24,25)/t14-,15-
(3)InChIKey: RIZQTCLNVHZQOO-SHTZXODSBR