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Name |
4-Pyridinemethanol hydrochloride |
EINECS | 263-493-3 |
CAS No. | 62302-28-7 | Density | N/A |
PSA | 33.12000 | LogP | 1.37590 |
Solubility | N/A | Melting Point |
N/A |
Formula | C6H7NO.HCl | Boiling Point | 272.1 °C at 760 mmHg |
Molecular Weight | 145.589 | Flash Point | 118.4 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
4-Pyridinemethanol,hydrochloride (9CI);4-pyridine methanol hydrochloride;4-hydroxymethylpiperidinium chloride; |
Article Data | 2 |
The 4-Pyridinemethanol hydrochloride with the cas number 62302-28-7 is also called 4-hydroxymethylpiperidinium chloride. Both the systematic name and IUPAC name are piperidin-4-ylmethanol hydrochloride. Its EINECS registry number is 263-493-3. The molecular formula is C6H7NO.HCl.
The properties of the chemical are: (1)# of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 8.73; (5)ACD/KOC (pH 7.4): 13.34; (6)#H bond acceptors: 2; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 2; (9)Polar Surface Area: 33.12Å2; (10)Enthalpy of Vaporization: 53.92 kJ/mol; (11)Vapour Pressure: 0.00303 mmHg at 25°C.
Uses: This chemical can react with 2-amino-ethanethiol; hydrochloride to prepare 2-[(4-aminoethyl)thiomethyl]pyridine dihydrobromide. This reaction needs reagent 48 percent HBr at heating condition. The reaction time is 18 hours. The yield is 72.5%.
You can still convert the following datas into molecular structure:
(1)SMILES: Cl.OCc1ccncc1
(2)InChI: InChI=1/C6H7NO.ClH/c8-5-6-1-3-7-4-2-6;/h1-4,8H,5H2;1H
(3)InChIKey: NKBJHERHVXOEIR-UHFFFAOYAU