4-(4'-Carboxyphenyl)piperidine HCl supplier

Name
4-(4''-CARBOXYPHENYL)PIPERIDINE HCL
EINECS
CAS No. 149353-84-4
Article Data4
CAS DataBase
Density
Solubility
Melting Point
Formula C₁₂H₁₆ClNO₂
Boiling Point 399.7 °C at 760 mmHg
Molecular Weight 241.718
Flash Point 195.5 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Benzoicacid, 4-(4-piperidinyl)-, hydrochloride (9CI);4-(4-Piperidinyl)benzoic acidhydrochloride;
PSA 49.33000
LogP 2.98260

4-(4'-Carboxyphenyl)piperidine HCl Specification

The Benzoic acid,4-(4-piperidinyl)-, hydrochloride (1:1), with the CAS registry number 149353-84-4, has the systematic name of 4-piperidin-4-ylbenzoic acid hydrochloride. And the molecular formula of this chemical is C₁₂H₁₆ClNO₂. In addition, it is also called 4-(4'-Carboxyphenyl)piperidine HCl.

The physical properties of Benzoic acid,4-(4-piperidinyl)-, hydrochloride (1:1) are as following: (1)ACD/LogP: 2.07; (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: 3; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 49.33 Å²; (11)Flash Point: 195.5 °C; (12)Enthalpy of Vaporization: 68.6 kJ/mol; (13)Boiling Point: 399.7 °C at 760 mmHg; (14)Vapour Pressure: 4.17E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cl.OC(=O)c1ccc(cc1)C2CCNCC2
(2)InChI: InChI=1/C12H15NO2.ClH/c14-12(15)11-3-1-9(2-4-11)10-5-7-13-8-6-10;/h1-4,10,13H,5-8H2,(H,14,15);1H
(3)InChIKey: VVWYZHFWAUQTKI-UHFFFAOYAH

Product Name

4-(4''-CARBOXYPHENYL)PIPERIDINE HCL

4-(4'-Carboxyphenyl)piperidine HCl Specification

Related Products

Hot Products