AG019LMJ

Name: 2-(2,2,2-Trifluoroethoxy)nicotinic acid
Brand: Angene Chemical
SKU: AG019LMJ

183368-79-8 | 2-(2,2,2-Trifluoroethoxy)nicotinic acid

AG019LMJ

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CAS Number	183368-79-8
Catalog Number	AG019LMJ(AGN-PC-0WOBA9)
Chemical Name	2-(2,2,2-Trifluoroethoxy)nicotinic acid
IUPAC Name	2-(2,2,2-trifluoroethoxy)pyridine-3-carboxylic acid
InChI	InChI=1S/C8H6F3NO3/c9-8(10,11)4-15-6-5(7(13)14)2-1-3-12-6/h1-3H,4H2,(H,13,14)
InChI Key	HNTZJRQSJJHBLG-UHFFFAOYSA-N
MDL Number	MFCD00114457
Molecular Formula	C8H6F3NO3
Molecular Weight	221.1333
SMILES	OC(C1=C(OCC(F)(F)F)N=CC=C1)=O
Synonyms	2-(2,2,2-trifluoroethoxy)nicotinic acid, 183368-79-8, 2-(2,2,2-trifluoroethoxy)pyridine-3-carboxylic acid, SCHEMBL456915, AC1Q72K4, CTK7I9846, HNTZJRQSJJHBLG-UHFFFAOYSA-N, MFCD00114457, SBB096096, ZINC12997612, AKOS000140439, KS-7529, MCULE-9993593094, NE25314, EN300-31779, 3-Pyridinecarboxylic acid, 2-(2,2,2-trifluoroethoxy)-, Z336481688,

Complexity	232
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	221.03g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	221.135g/mol
Monoisotopic Mass	221.03g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	59.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited