2-(2-Pyridyl)-4-methylthiazole-5-carboxylic acid - CAS 34418-48-9

Catalog:	BB022130
Product Name:	2-(2-Pyridyl)-4-methylthiazole-5-carboxylic acid
CAS:	34418-48-9
Synonyms:	4-methyl-2-pyridin-2-yl-1,3-thiazole-5-carboxylic acid

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	4-methyl-2-pyridin-2-yl-1,3-thiazole-5-carboxylic acid
Description:	2-(2-Pyridyl)-4-methylthiazole-5-carboxylic acid (CAS# 34418-48-9) is a useful research chemical.
Molecular Weight:	220.25
Molecular Formula:	C10H8N2O2S
Canonical SMILES:	CC1=C(SC(=N1)C2=CC=CC=N2)C(=O)O
InChI:	InChI=1S/C10H8N2O2S/c1-6-8(10(13)14)15-9(12-6)7-4-2-3-5-11-7/h2-5H,1H3,(H,13,14)
InChI Key:	QFDHWPOPCNNAOI-UHFFFAOYSA-N
Boiling Point:	457.3 °C at 760 mmHg
Density:	1.381 g/cm³
Appearance:	White crystalline powder
MDL:	MFCD01316364
LogP:	2.21170

Publication Number	Title	Priority Date
CN-110922398-A	Production method of 2-pyridyl-4-methylthiazole-5-carboxylic acid bisabolone ester spice	20191128
CN-110922399-A	Synthesis method of 2-pyridyl-4-methylthiazole-5-carboxylic acid bisabolone ester spice	20191128
CN-110922398-B	Production method of 2-pyridyl-4-methylthiazole-5-carboxylic acid bisabolone ester spice	20191128
CN-110922399-B	Synthesis method of 2-pyridyl-4-methylthiazole-5-carboxylic acid bisabolone ester spice	20191128
CN-211445579-U	Production device of bisabolol alkene ester spice	20191128

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Related Functional Groups

Carbonyl Compounds

[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[70199-62-1]
(4-Pyridyl)acetone Hydrochloride
[1018141-88-2]
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
[957292-12-5]
2-(3-Cyclopropyl-1H-pyrazol-1-yl)acetic acid
[927676-51-5]
2-(6-Bromo-3-indolyl)-2-oxoacetic Acid

Oxazole/Thiazole

[859473-05-5]
N-(3,4-Dichlorophenyl)-1,3-thiazol-2-amine
[1401934-53-9]
2-Amino-4-(3,4-dimethoxyphenyl)-5-phenylthiazole
[3973-08-8]
4-Thiazolecarboxylic acid
[16188-30-0]
4-Thiazolemethanamine
[13610-81-6]
(2-Oxo-1,3-benzoxazol-3(2H)-yl)acetaldehyde
[117043-86-4]
4-(Aminomethyl)thiazole Hydrochloride

GHS Hazard Statement:	H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement:	P264, P280, P305+P351+P338, and P337+P313
Signal Word:	Warning

Complexity:	250
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	220.03064868
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	220.03064868
Rotatable Bond Count:	2
Topological Polar Surface Area:	91.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.8