CAS No.133897-06-0,2,4-DIMETHYL-3-PYRIDINECARBOXYLIC ACID HYDROCHLORIDE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	133897-06-0
Name:	2,4-DIMETHYL-3-PYRIDINECARBOXYLIC ACID HYDROCHLORIDE

Formula:	C₈H₁₀ClNO₂
Molecular Weight:	187.626
Synonyms:	3-Pyridinecarboxylicacid, 2,4-dimethyl-, hydrochloride (9CI);2,4-Dimethylnicotinic acid hydrochloride;2,4-Dimethylpyridine-3-carboxylic acid hydrochloride;
Boiling Point:	326.2 °C at 760 mmHg
Flash Point:	151.1 °C
PSA:	50.19000
LogP:	2.19860

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Specification

The 3-Pyridinecarboxylicacid, 2,4-dimethyl-, hydrochloride (1:1) is an organic compound with the formula C₈H₁₀ClNO₂. The systematic name of this chemical is 2,4-dimethylpyridine-3-carboxylic acid hydrochloride. With the CAS registry number 133897-06-0, it is also named as 2,4-Dimethylnicotinic acid hydrochloride (1:1).

Physical properties about 3-Pyridinecarboxylicacid, 2,4-dimethyl-, hydrochloride (1:1) are: (1)ACD/LogP: 1.07; (2)#H bond acceptors: 3; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 1; (5)Polar Surface Area: 50.19 Å²; (6)Flash Point: 151.1 °C; (7)Enthalpy of Vaporization: 60.01 kJ/mol; (8)Boiling Point: 326.2 °C at 760 mmHg; (9)Vapour Pressure: 8.88E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)c1c(C)ccnc1C.Cl
(2)InChI: InChI=1/C8H9NO2.ClH/c1-5-3-4-9-6(2)7(5)8(10)11;/h3-4H,1-2H3,(H,10,11);1H
(3)InChIKey: INDASXALZAWOPK-UHFFFAOYAB
(4)Std. InChI: InChI=1S/C8H9NO2.ClH/c1-5-3-4-9-6(2)7(5)8(10)11;/h3-4H,1-2H3,(H,10,11);1H
(5)Std. InChIKey: INDASXALZAWOPK-UHFFFAOYSA-N