AG00A073

134510-03-5 | 5-Trifluoromethyl-pyrazin-2-ol

AG00A073

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CAS Number	134510-03-5
Catalog Number	AG00A073(AGN-PC-02PGVI)
Chemical Name	5-Trifluoromethyl-pyrazin-2-ol
IUPAC Name	5-(trifluoromethyl)-1H-pyrazin-2-one
InChI	InChI=1S/C5H3F3N2O/c6-5(7,8)3-1-10-4(11)2-9-3/h1-2H,(H,10,11)
InChI Key	FZBNWYMJWPBFAS-UHFFFAOYSA-N
MDL Number	MFCD13190191
Molecular Formula	C5H3F3N2O
Molecular Weight	164.0853
SMILES	OC1=NC=C(C(F)(F)F)N=C1
Synonyms	134510-03-5, 5-(TRIFLUOROMETHYL)PYRAZIN-2-OL, 5-Trifluoromethyl-pyrazin-2-ol, 2(1H)-Pyrazinone, 5-(trifluoromethyl)-, 5-HYDROXY-2-(TRIFLUOROMETHYL)PYRAZINE, 5-trifluoromethylpyrazin-2-one, SCHEMBL1931544, 5-trifluoromethylpyrazine-2-one, SCHEMBL19707458, 5-(Trifluoromethyl)pyrazin-2-one, FZBNWYMJWPBFAS-UHFFFAOYSA-N, MFCD23382443, ZINC81137940, AKOS017344735, AKOS030529222, 5-(trifluoromethyl)pyrazin-2(1H)-one, AB69940, CS-W004214, AS-47580, FT-0706221,

Complexity	241
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	164.02g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	164.087g/mol
Monoisotopic Mass	164.02g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	41.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H320-H335
Packing Group
Precautionary statements	P264-P270-P301+P312-P330
UN Code

Certificate of Analysis

Lot Number