3-Pyridinecarboxylic acid, 6-(dimethylamino)- supplier

Name
6-(DIMETHYLAMINO)NICOTINIC ACID
EINECS 145-896-5
CAS No. 82846-28-4
Article Data7
CAS DataBase
Density 1.247g/cm³
Solubility
Melting Point
Formula C₈H₁₀N₂O₂
Boiling Point 338.131 °C at 760 mmHg
Molecular Weight 166.18
Flash Point 158.296 °C
Transport Information
Appearance
Safety 36/37
Risk Codes 43
Molecular Structure
Hazard Symbols Xi
Synonyms 6-(Dimethylamino)-nicotinic acid;6-dimethylaminopyridine-3-carboxylic acid;6-(Dimethylamino)nicotinic acid;
PSA 53.43000
LogP 0.84580

3-Pyridinecarboxylic acid, 6-(dimethylamino)- Specification

The 3-Pyridinecarboxylic acid, 6-(dimethylamino)-, with the CAS registry number 82846-28-4, belongs to the product categories Building Blocks; Pyridine. It has the IUPAC name of 6-(dimethylamino)pyridine-3-carboxylic acid. Moreover, its molecular formula is C₈H₁₀N₂O₂and its molecular weight is 166.18.

Other characteristics of the 3-Pyridinecarboxylic acid, 6-(dimethylamino)- can be summarised as followings: (1)ACD/LogP: 1.10; (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: 4; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 53.43 Å²; (11)Index of Refraction: 1.6; (12)Molar Refractivity: 45.588 cm³; (13)Molar Volume: 133.178 cm³; (14)Polarizability: 18.072×10^-24cm³; (15)Surface Tension: 56.778 dyne/cm; (16)Density: 1.248 g/cm³; (17)Flash Point: 158.296 °C; (18)Enthalpy of Vaporization: 61.37 kJ/mol; (19)Boiling Point: 338.131 °C at 760 mmHg; (20)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: CN(C)c1ccc(cn1)C(=O)O
2.InChI: InChI=1/C8H10N2O2/c1-10(2)7-4-3-6(5-9-7)8(11)12/h3-5H,1-2H3,(H,11,12)
3.InChIKey: XWMLEYINWKGSAC-UHFFFAOYAY

Product Name

6-(DIMETHYLAMINO)NICOTINIC ACID

3-Pyridinecarboxylic acid, 6-(dimethylamino)- Specification

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