CAS No.21801-79-6,2-METHYLIMIDAZO[1,2-A]PYRIDINE-3-CARBOXYLIC ACID Suppliers

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Basic Information

Molecular Structure:
CAS No.:	21801-79-6
Name:	2-METHYLIMIDAZO[1,2-A]PYRIDINE-3-CARBOXYLIC ACID
Article Data:	12

Formula:	C₉H₈N₂O₂
Molecular Weight:	176.175
Synonyms:	NSC 156822;
Density:	1.359 g/cm³
Melting Point:	140 °C
Boiling Point:	170°C
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	26-36/37/39
PSA:	54.60000
LogP:	1.34090

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Specification

The 2-Methylimidazo[1,2-a]pyridine-3-carboxylic acid with the cas number 21801-79-6. It is also called imidazo[1,2-a]pyridine-3-carboxylic acid, 2-methyl- . It belongs to the following product categories:(1)Carboxylic Acids; (2)Fused Ring Systems.

Properties of 2-Methylimidazo[1,2-a]pyridine-3-carboxylic acid: (1)ACD/LogP: 1.49 ; (2)# of Rule of 5 Violations: 0 ; (3)ACD/LogD (pH 5.5): -1.02 ; (4)ACD/LogD (pH 7.4): -1.16 ; (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: 1 ; (11)#Freely Rotating Bonds: 1 ; (12)Polar Surface Area: 43.6Å² ; (13)Index of Refraction: 1.653 ; (14)Molar Refractivity: 47.44 cm³; (15)Molar Volume: 129.5 cm³ ; (16)Polarizability: 18.81 10-24cm³ ; (17)Surface Tension: 53.1 dyne/cm ; (18)Density: 1.35 g/cm³

The 2-Methylimidazo[1,2-a]pyridine-3-carboxylic acid is quite irritating to eyes, respiratory system and skin. Before you are, wear suitable protective clothing, gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

The 2-Methylimidazo[1,2-a]pyridine-3-carboxylic acid can be obtained from 2-methyl-imidazo[1,2-a]pyridine-3-carboxylic acid ethyl ester heating for 1 hour(s), Yield is 62 %.

You can still convert the following datas into molecular structure :
1. SMILES: O=C(O)c1c(nc2ccccn12)C
2. InChI: InChI=1/C9H8N2O2/c1-6-8(9(12)13)11-5-3-2-4-7(11)10-6/h2-5H,1H3,(H,12,13)

Toxic information of 2-Methylimidazo[1,2-a]pyridine-3-carboxylic acid can be showed as the following:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mouse	LD50	intraperitoneal	600mg/kg (600mg/kg)	BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY) BEHAVIORAL: IRRITABILITY	Journal of Medicinal Chemistry. Vol. 12, Pg. 122, 1969.