CAS No.189819-75-8,1-BOC-4-AMINO-PIPERIDINE HYDROCHLORIDE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	189819-75-8
Name:	1-BOC-4-AMINO-PIPERIDINE HYDROCHLORIDE

Formula:	C₁₀H₂₁ClN₂O₂
Molecular Weight:	236.742
Synonyms:	1-Piperidinecarboxylicacid, 4-amino-, 1,1-dimethylethyl ester, monohydrochloride (9CI);tert-Butyl 4-aminopiperidine-1-carboxylatehydrochloride;1-BOC-4-aminopiperidine hydrochloride;4-Aminopiperidine-1-carboxylic acidtert-butyl ester hydrochloride;
Boiling Point:	277.3 °C at 760 mmHg
Flash Point:	121.5 °C
Safety:	24/25
PSA:	55.56000
LogP:	2.78480

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Specification

The 1-Piperidinecarboxylicacid, 4-amino-, 1,1-dimethylethyl ester, hydrochloride (1:1), with the CAS registry number 189819-75-8, is also known as 2-Methyl-2-propanyl 4-amino-1-piperidinecarboxylate hydrochloride. This chemical's molecular formula is C₁₀H₂₁ClN₂O₂ and molecular weight is 236.7389. Its systematic name is called tert-butyl 4-aminopiperidine-1-carboxylate hydrochloride.

Physical properties of 1-Piperidinecarboxylicacid, 4-amino-, 1,1-dimethylethyl ester, hydrochloride (1:1): (1)ACD/LogP: 0.67; (2)ACD/LogD (pH 5.5): -2.37; (3)ACD/LogD (pH 7.4): -1.3; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 4; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 3; (11)Flash Point: 121.5 °C; (12)Enthalpy of Vaporization: 51.59 kJ/mol; (13)Boiling Point: 277.3 °C at 760 mmHg; (14)Vapour Pressure: 0.00456 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cl.O=C(OC(C)(C)C)N1CCC(N)CC1
(2)InChI: InChI=1/C10H20N2O2.ClH/c1-10(2,3)14-9(13)12-6-4-8(11)5-7-12;/h8H,4-7,11H2,1-3H3;1H
(3)InChIKey: KLOQZAJAQQKCNC-UHFFFAOYAF