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3-Methylpicolinic acid hydrochloride

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Name

3-Methylpicolinic acid hydrochloride

EINECS N/A
CAS No. 123811-72-3 Density N/A
PSA 50.19000 LogP 1.08820
Solubility N/A Melting Point N/A
Formula C7H8ClNO2 Boiling Point N/A
Molecular Weight 173.02 Flash Point N/A
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 123811-72-3 (3-METHYLPICOLINIC ACID HYDROCHLORIDE) Hazard Symbols N/A
Synonyms

2-Pyridinecarboxylicacid, 3-methyl-, hydrochloride (9CI);3-methylpyridine-2-carboxylic acid hydrochloride;3-Methylpyridine-2-carboxylic acid hydrochloride (1:1);2-pyridinecarboxylic acid, 3-methyl-, hydrochloride (1:1);

 

3-Methylpicolinic acid hydrochloride Specification

The 2-Pyridinecarboxylicacid, 3-methyl-, hydrochloride (1:1), with the CAS registry number 123811-72-3, has the systematic name and IUPAC name of 3-methylpyridine-2-carboxylic acid hydrochloride. And the molecular formula of the chemical is C7H8ClNO2.

The characteristics of 2-Pyridinecarboxylicacid, 3-methyl-, hydrochloride (1:1) are as followings: (1)H-Bond Donor 2; (2)H-Bond Acceptor 3; (3)Rotatable Bond Count 1; (4)Exact Mass 173.024356; (5)MonoIsotopic Mass 173.024356; (6)Topological Polar Surface Area 50.2; (7)Heavy Atom Count 11; (8)Formal Charge 0; (9)Complexity 136; (10)Isotope Atom Count 0; (11)Defined Atom StereoCenter Count 0; (12)Undefined Atom StereoCenter Count 0; (13)Defined Bond StereoCenter Count 0; (14)Undefined Bond StereoCenter Count 0; (15)Covalently-Bonded Unit Count 2. 

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Cc1cccnc1C(=O)O.Cl
(2)InChI: InChI=1/C7H7NO2.ClH/c1-5-3-2-4-8-6(5)7(9)10;/h2-4H,1H3,(H,9,10);1H
(3)InChIKey: ADZVDJRKIHGDQW-UHFFFAOYAL

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