Ethyl 4-fluoropiperidine-4-carboxylate supplier

Name
Ethyl 4-fluoropiperidine-4-carboxylate
EINECS
CAS No. 845958-77-2
Article Data3
CAS DataBase
Density 1.101 g/cm³
Solubility
Melting Point
Formula C₈H₁₄FNO₂
Boiling Point 207.602 °C at 760 mmHg
Molecular Weight 175.203
Flash Point 79.355 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-Fluoro-piperidine-4-carboxylic acid ethyl ester;
PSA 38.33000
LogP 0.97000

Ethyl 4-fluoropiperidine-4-carboxylate Specification

The Ethyl 4-fluoropiperidine-4-carboxylate has CAS registry number 845958-77-2. This chemical's molecular formula is C₈H₁₄FNO₂ and molecular weight is 175.202. What's more, its systematic name is Ethyl 4-fluoropiperidine-4-carboxylate.

Physical properties about Ethyl 4-fluoropiperidine-4-carboxylate are: (1)ACD/LogP: -0.34; (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): 5; (7)#H bond acceptors: 3; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 3; (10)Polar Surface Area: 38.33 Å²; (11)Index of Refraction: 1.449; (12)Molar Refractivity: 42.676 cm³; (13)Molar Volume: 159.193 cm³; (14)Polarizability: 16.918×10^-24 cm³; (15)Surface Tension: 32.476 dyne/cm; (16)Density: 1.101 g/cm³; (17)Flash Point: 79.355 °C; (18)Enthalpy of Vaporization: 44.386 kJ/mol; (19)Boiling Point: 207.602 °C at 760 mmHg; (20)Vapour Pressure: 0.223 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(OCC)C1(F)CCNCC1
(2) InChI: InChI=1/C8H14FNO2/c1-2-12-7(11)8(9)3-5-10-6-4-8/h10H,2-6H2,1H3
(3) InChIKey: IRHZQIJIMBFMKC-UHFFFAOYAL

Product Name

Ethyl 4-fluoropiperidine-4-carboxylate

Ethyl 4-fluoropiperidine-4-carboxylate Specification

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