6-Aminonicotinic acid hydrochloride supplier

Name
6-AMINO-NICOTINIC ACID HCL
EINECS
CAS No. 5336-87-8
Article Data2
CAS DataBase
Density
Solubility
Melting Point
Formula C₆H₆N₂O₂^.HCl
Boiling Point 373.6 °C at 760 mmHg
Molecular Weight 174.587
Flash Point 179.8 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 3-Pyridinecarboxylicacid, 6-amino-, monohydrochloride (9CI);Nicotinic acid, 6-amino-, hydrochloride(8CI);6-Aminonicotinic acid monohydrochloride;6-aminopyridine-3-carboxylic acid hydrochloride;6-Amino-nicotinic acid HCl;6-Aminonicotinic acid hydrochloride;3-pyridinecarboxylic acid, 6-amino-, hydrochloride (1:1);3-Pyridinecarboxylic acid, 6-amino-, monohydrochloride;
PSA 76.21000
LogP 1.74520

6-Aminonicotinic acid hydrochloride Specification

The 6-Aminonicotinic acid hydrochloride, with the CAS registry number 5336-87-8, has the systematic name of 6-aminopyridine-3-carboxylic acid hydrochloride. It belongs to the product category of Pharmacetical. The molecular formula of the chemical is C₆H₆N₂O₂^.HCl.

The characteristics of this chemical are as followings: (1)ACD/LogP: 0.26; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.76; (4)ACD/LogD (pH 7.4): -2.59; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 4; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 1 ; (12)Flash Point: 179.8 °C; (13)Enthalpy of Vaporization: 65.5 kJ/mol; (14)Boiling Point: 373.6 °C at 760 mmHg; (15)Vapour Pressure: 3.03E-06 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=C(O)c1cnc(N)cc1.Cl
(2)InChI: InChI=1/C6H6N2O2.ClH/c7-5-2-1-4(3-8-5)6(9)10;/h1-3H,(H2,7,8)(H,9,10);1H
(3)InChIKey: KPOMCBXVDGLPOJ-UHFFFAOYAN

Product Name

6-AMINO-NICOTINIC ACID HCL

6-Aminonicotinic acid hydrochloride Specification

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