1-Boc-4-fluoro-4-piperidinecarboxylic acid supplier

Name
1-Boc-4-fluoro-4-piperidinecarboxylic acid
EINECS
CAS No. 614731-04-3
Article Data2
CAS DataBase
Density 1.223 g/cm³
Solubility
Melting Point
Formula C₁₁H₁₈FNO₄
Boiling Point 346.275 °C at 760 mmHg
Molecular Weight 247.26
Flash Point 163.221 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1-BOC-4-FLUORO-4-PIPERIDINECARBOXYLIC ACID;1-(tert-butoxycarbonyl)-4-fluoropiperidine-4-carboxylic acid;1-Boc-4-fluoropiperidine-4-carboxylic acid;1-Boc-4-fluoropiperidine-...;1,4-Piperidinedicarboxylic acid, 4-fluoro-, 1-(1,1-diMethylethyl) ester;1-(tert-Butoxycarbonyl)-4-fluoropiperidine-4-carboxylic acid, 1-(tert-Butoxycarbonyl)-4-carboxy-4-fluoropiperidine;4-Fluoropiperidine-4-carboxylic acid, N-BOC protected 95%
PSA 66.84000
LogP 1.74810

1-Boc-4-fluoro-4-piperidinecarboxylic acid Specification

This chemical is called 1-Boc-4-fluoro-4-piperidinecarboxylic acid, and its systematic name is 1-(tert-butoxycarbonyl)-4-fluoropiperidine-4-carboxylic acid. With the molecular formula of C₁₁H₁₈FNO₄, its molecular weight is 247.26. The CAS registry number of this chemical is 614731-04-3.

Other characteristics of the 1-Boc-4-fluoro-4-piperidinecarboxylic acid can be summarised as followings: (1)ACD/LogP: 1.46; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 5; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 3; (10)Polar Surface Area: 66.84 Å²; (11)Index of Refraction: 1.49; (12)Molar Refractivity: 58.457 cm³; (13)Molar Volume: 202.155 cm³; (14)Polarizability: 23.174×10^-24cm³; (15)Surface Tension: 42.702 dyne/cm; (16)Density: 1.223 g/cm³; (17)Flash Point: 163.221 °C; (18)Enthalpy of Vaporization: 64.878 kJ/mol; (19)Boiling Point: 346.275 °C at 760 mmHg; (20)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: OC(=O)C1(F)CCN(CC1)C(=O)OC(C)(C)C
2.InChI: InChI=1/C11H18FNO4/c1-10(2,3)17-9(16)13-6-4-11(12,5-7-13)8(14)15/h4-7H2,1-3H3,(H,14,15)
3.InChIKey:NRQOTEPIFSRDMH-UHFFFAOYAL

Product Name

1-Boc-4-fluoro-4-piperidinecarboxylic acid

1-Boc-4-fluoro-4-piperidinecarboxylic acid Specification

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