Basic Information | Post buying leads | Suppliers |
Name |
4-(Aminomethyl)-1-n-fmoc-piperidine |
EINECS | N/A |
CAS No. | 391248-14-9 | Density | N/A |
PSA | 55.56000 | LogP | 5.04640 |
Solubility | N/A | Melting Point |
N/A |
Formula | C21H25ClN2O2 | Boiling Point | 509.2 °C at 760 mmHg |
Molecular Weight | 372.16 | Flash Point | 261.7 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
1-Piperidinecarboxylicacid, 4-(aminomethyl)-, 9H-fluoren-9-ylmethyl ester, monohydrochloride (9CI); |
The 1-Piperidinecarboxylicacid, 4-(aminomethyl)-, 9H-fluoren-9-ylmethyl ester, hydrochloride (1:1), with CAS registry number 391248-14-9, has the systematic name of 9H-fluoren-9-ylmethyl 4-(aminomethyl)piperidine-1-carboxylate hydrochloride. Besides this, it is also called 4-(Aminomethyl)-1-n-fmoc-piperidine. And the chemical formula of this chemical is C21H25ClN2O2.
Physical properties of 1-Piperidinecarboxylicacid, 4-(aminomethyl)-, 9H-fluoren-9-ylmethyl ester, hydrochloride (1:1): (1)ACD/LogP: 3.38; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.29; (4)ACD/LogD (pH 7.4): 0.8; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1.35; (8)ACD/KOC (pH 7.4): 4.36; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 32.78 Å2; (13)Flash Point: 261.7 °C; (14)Enthalpy of Vaporization: 77.97 kJ/mol; (15)Boiling Point: 509.2 °C at 760 mmHg; (16)Vapour Pressure: 1.74E-10 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCC3c1ccccc1c2ccccc23)N4CCC(CN)CC4.Cl
(2)InChI: InChI=1/C21H24N2O2.ClH/c22-13-15-9-11-23(12-10-15)21(24)25-14-20-18-7-3-1-5-16(18)17-6-2-4-8-19(17)20;/h1-8,15,20H,9-14,22H2;1H
(3)InChIKey: XJPZHAOBBSZRGF-UHFFFAOYAV
(4)Std. InChI: InChI=1S/C21H24N2O2.ClH/c22-13-15-9-11-23(12-10-15)21(24)25-14-20-18-7-3-1-5-16(18)17-6-2-4-8-19(17)20;/h1-8,15,20H,9-14,22H2;1H
(5)Std. InChIKey: XJPZHAOBBSZRGF-UHFFFAOYSA-N