3-N-Fmoc-amino-piperidine hydrochloride supplier

Name
3-N-Fmoc-amino-piperidine hydrochloride
EINECS
CAS No. 672310-13-3
Density
Solubility
Melting Point
Formula C₂₀H₂₃ClN₂O₂
Boiling Point 520.4 °C at 760 mmHg
Molecular Weight 358.8618
Flash Point 268.5 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 3-N-Fmoc-aminopiperidinehydrochloride;9H-Fluoren-9-ylmethyl piperidin-3-ylcarbamate hydrochloride (1:1);Carbamic acid, N-3-piperidinyl-, 9H-fluoren-9-ylmethyl ester, hydrochloride (1:1);Piperidin-3-yl-carbamic acid 9H-fluoren-9-ylmethyl ester hydrochloride;
PSA 50.36000
LogP 4.79880

3-N-Fmoc-amino-piperidine hydrochloride Specification

The systematic name of 3-N-Fmoc-amino-piperidine hydrochloride is 9H-fluoren-9-ylmethyl piperidin-3-ylcarbamate hydrochloride. With the CAS registry number 672310-13-3, it is also named as Piperidin-3-yl-carbamic acid 9H-fluoren-9-ylmethyl ester hydrochloride. In addition, its molecular formula is C₂₀H₂₃ClN₂O₂and its molecular weight is 358.8618.

The other characteristics of 3-N-Fmoc-amino-piperidine hydrochloride can be summarized as: (1)ACD/LogP: 3.81; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.73; (4)ACD/LogD (pH 7.4): 1.47; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 2.11; (7)ACD/KOC (pH 5.5): 2.36; (8)ACD/KOC (pH 7.4): 12.84; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 32.78 Å²; (13)Flash Point: 268.5 °C; (14)Enthalpy of Vaporization: 79.33 kJ/mol; (15)Boiling Point: 520.4 °C at 760 mmHg; (16)Vapour Pressure: 6.28E-11 mmHg at 25 °C.

People can use the following data to convert to the molecule structure.
(1)SMILES: O=C(OCC3c1ccccc1c2ccccc23)NC4CCCNC4.Cl
(2)InChI: InChI=1/C20H22N2O2.ClH/c23-20(22-14-6-5-11-21-12-14)24-13-19-17-9-3-1-7-15(17)16-8-2-4-10-18(16)19;/h1-4,7-10,14,19,21H,5-6,11-13H2,(H,22,23);1H
(3)InChIKey: NSNXXBDVQCSPJY-UHFFFAOYAM
(4)Std. InChI: InChI=1S/C20H22N2O2.ClH/c23-20(22-14-6-5-11-21-12-14)24-13-19-17-9-3-1-7-15(17)16-8-2-4-10-18(16)19;/h1-4,7-10,14,19,21H,5-6,11-13H2,(H,22,23);1H
(5)Std. InChIKey: NSNXXBDVQCSPJY-UHFFFAOYSA-N

Product Name

3-N-Fmoc-amino-piperidine hydrochloride

3-N-Fmoc-amino-piperidine hydrochloride Specification

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