AG00IFV8

Name: 5-(4-Trifluoromethoxyphenyl)nicotinic acid
Brand: Angene Chemical
SKU: AG00IFV8

898796-62-8 | 5-(4-Trifluoromethoxyphenyl)nicotinic acid

AG00IFV8

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CAS Number	898796-62-8
Catalog Number	AG00IFV8(AGN-PC-04Q6EN)
Chemical Name	5-(4-Trifluoromethoxyphenyl)nicotinic acid
IUPAC Name	5-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxylic acid
InChI	InChI=1S/C13H8F3NO3/c14-13(15,16)20-11-3-1-8(2-4-11)9-5-10(12(18)19)7-17-6-9/h1-7H,(H,18,19)
InChI Key	ZDGFIIFSNCNIMW-UHFFFAOYSA-N
MDL Number	MFCD06410279
Molecular Formula	C13H8F3NO3
Molecular Weight	283.2027
SMILES	FC(OC1C=CC(=CC=1)C1=CN=CC(C(O)=O)=C1)(F)F
Synonyms	898796-62-8, 5-(4-(TRIFLUOROMETHOXY)PHENYL)NICOTINIC ACID, 5-(4-Trifluoromethoxyphenyl)-nicotinic acid, 5-[4-(Trifluoromethoxy)phenyl]nicotinic acid, 5-[4-(TRIFLUOROMETHOXY)PHENYL]PYRIDINE-3-CARBOXYLIC ACID, DTXSID20646969, 6306AJ, KM2883, MFCD06410279, ZINC35630008, AKOS010806092, AB24287, AK183833, DS-10013, SY032713, AX8273196, MFCD06410279 (95%), 5-(4-TRIFLUOROMETHOXYPHENYL)NICOTINIC ACID, C13H8F3NO3,

Complexity	340
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	283.046g/mol
Formal Charge	0
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	283.206g/mol
Monoisotopic Mass	283.046g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	59.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.2

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