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3-Piperidin-4-yl-propionic acid

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Name

3-Piperidin-4-yl-propionic acid

EINECS N/A
CAS No. 1822-32-8 Density 1.04 g/cm3
PSA 49.33000 LogP 1.17960
Solubility N/A Melting Point 275-277℃
Formula C8H15NO2 Boiling Point 299.364 °C at 760 mmHg
Molecular Weight 157.213 Flash Point 134.851 °C
Transport Information N/A Appearance N/A
Safety 26-39 Risk Codes 41
Molecular Structure Molecular Structure of 1822-32-8 (3-Piperidin-4-yl-propionic acid) Hazard Symbols Xi
Synonyms

4-Piperidinepropionicacid (6CI,7CI,8CI);

Article Data 20

3-Piperidin-4-yl-propionic acid Specification

The 4-Piperidinepropanoicacid, with the CAS registry number 1822-32-8, is also known as 3-(4-Piperidinyl)propanoic acid. It belongs to the product category of Pharmacetical. This chemical's molecular formula is C8H15NO2 and molecular weight is 157.2102. Its IUPAC name is called 3-piperidin-4-ylpropanoic acid.

Physical properties of 4-Piperidinepropanoicacid: (1)ACD/LogP: 0.38; (2)ACD/LogD (pH 5.5): -2.16; (3)ACD/LogD (pH 7.4): -2.12; (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: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 3; (11)Index of Refraction: 1.466; (12)Molar Refractivity: 41.93 cm3; (13)Molar Volume: 151.1 cm3; (14)Surface Tension: 39.3 dyne/cm; (15)Density: 1.039 g/cm3; (16)Flash Point: 134.9 °C; (17)Enthalpy of Vaporization: 59.33 kJ/mol; (18)Boiling Point: 299.4 °C at 760 mmHg; (19)Vapour Pressure: 0.000284 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1CNCCC1CCC(=O)O
(2)InChI: InChI=1S/C8H15NO2/c10-8(11)2-1-7-3-5-9-6-4-7/h7,9H,1-6H2,(H,10,11)
(3)InChIKey: AUYQMCCWFNSFGV-UHFFFAOYSA-N

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