CAS No.154874-94-9,N-BOC-4-CHLORO-PIPERIDINE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	154874-94-9
Name:	N-BOC-4-CHLORO-PIPERIDINE

Formula:	C₁₀H₁₈ClNO₂
Molecular Weight:	219.71
Synonyms:	1-Piperidinecarboxylic acid, 4-chloro-, 1,1-dimethylethyl ester;tert-Butyl 4-chloropiperidine-1-carboxylate;4-Chloro-piperidine-1-carboxylic acid tert-butyl ester;
Density:	1.111 g/cm³
Boiling Point:	289.697 °C at 760 mmHg
Flash Point:	129.005 °C
PSA:	29.54000
LogP:	2.56260

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Specification

The 1-Piperidinecarboxylicacid, 4-chloro-, 1,1-dimethylethyl ester, with the CAS registry number 154874-94-9, is also known as 1-Piperidinecarboxylic acid, 4-chloro-, 1,1-dimethylethyl ester. This chemical's molecular formula is C₁₀H₁₈ClNO₂ and molecular weight is 219.7084. Its systematic name is called tert-butyl 4-chloropiperidine-1-carboxylate.

Physical properties of 1-Piperidinecarboxylicacid, 4-chloro-, 1,1-dimethylethyl ester: (1)ACD/LogP: 2.50; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3; (4)ACD/LogD (pH 7.4): 3; (5)ACD/BCF (pH 5.5): 47; (6)ACD/BCF (pH 7.4): 47; (7)ACD/KOC (pH 5.5): 548; (8)ACD/KOC (pH 7.4): 548; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Index of Refraction: 1.487; (13)Molar Refractivity: 56.858 cm³; (14)Molar Volume: 197.817 cm³; (15)Surface Tension: 36.426 dyne/cm; (16)Density: 1.111 g/cm³; (17)Flash Point: 129.005 °C; (18)Enthalpy of Vaporization: 52.902 kJ/mol; (19)Boiling Point: 289.697 °C at 760 mmHg; (20)Vapour Pressure: 0.002 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CC(C)(C)OC(=O)N1CCC(CC1)Cl
(2)InChI: InChI=1/C10H18ClNO2/c1-10(2,3)14-9(13)12-6-4-8(11)5-7-12/h8H,4-7H2,1-3H3
(3)InChIKey: NZZWXABIGMMKQL-UHFFFAOYAR