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2-Methoxy-4-(trifluoromethyl)thiazole-5-carboxylic Acid

2-Methoxy-4-(trifluoromethyl)thiazole-5-carboxylic Acid - CAS 1226776-93-7

Catalog:	BB005451
Product Name:	2-Methoxy-4-(trifluoromethyl)thiazole-5-carboxylic Acid
CAS:	1226776-93-7
Synonyms:	2-methoxy-4-(trifluoromethyl)-5-thiazolecarboxylic acid; 2-methoxy-4-(trifluoromethyl)-1,3-thiazole-5-carboxylic acid

Technical Data

Patents

Computed Properties

IUPAC Name:	2-methoxy-4-(trifluoromethyl)-1,3-thiazole-5-carboxylic acid
Description:	2-Methoxy-4-(trifluoromethyl)thiazole-5-carboxylic Acid (CAS# 1226776-93-7) is a useful research chemical.
Molecular Weight:	227.16
Molecular Formula:	C6H4F3NO3S
Canonical SMILES:	COC1=NC(=C(S1)C(=O)O)C(F)(F)F
InChI:	InChI=1S/C6H4F3NO3S/c1-13-5-10-3(6(7,8)9)2(14-5)4(11)12/h1H3,(H,11,12)
InChI Key:	DAGFIURSOZGKLT-UHFFFAOYSA-N
LogP:	1.86870

Publication Number	Title	Priority Date
CA-3066942-A1	Diazabicyclic substituted imidazopyrimidines and their use for the treatment of breathing disorders	20170614
WO-2014187297-A1	N-pyridine(hetero)aromatic amide compound and preparation method and use thereof	20130520
JP-2585379-B2	Method for producing thiazole carboxylic acid chlorides	19880620
EP-0377750-A1	Process for preparing thiazolecarboxylic acid chlorides	19880603
KR-920005826-B1	Process for preparing thiazole carboxylic acid chloride	19880603

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Related Functional Groups

Carbonyl Compounds

[70912-52-6]
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-
[2168559-63-3]
2-(6-Methyl-2-pyridyl)acetic Acid Hydrochloride
[1018125-51-3]
2-(6-Ethyl-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid
[1016519-61-1]
2-(Methyl-2-pyridylamino)acetic Acid
[17432-37-0]
2,3,5,6-Tetramethylbenzaldehyde
[108397-75-7]
2,4,6-Trimethylpyrimidine-5-carboxylic Acid

Complexity:	235
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	226.98639865
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	8
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	226.98639865
Rotatable Bond Count:	2
Topological Polar Surface Area:	87.7
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2