AG00H9YA

1030632-94-0 | 5-Ethyl-2-(trifluoromethyl)pyridine

AG00H9YA

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CAS Number	1030632-94-0
Catalog Number	AG00H9YA(AGN-PC-0WD5NK)
Chemical Name	5-Ethyl-2-(trifluoromethyl)pyridine
IUPAC Name	5-ethyl-2-(trifluoromethyl)pyridine
InChI	InChI=1S/C8H8F3N/c1-2-6-3-4-7(12-5-6)8(9,10)11/h3-5H,2H2,1H3
InChI Key	SMZCIFQBUAWRNQ-UHFFFAOYSA-N
MDL Number	MFCD19689817
Molecular Formula	C8H8F3N
Molecular Weight	175.1510
SMILES	FC(C1=NC=C(CC)C=C1)(F)F
Synonyms	5-Ethyl-2-(trifluoromethyl)pyridine, 1030632-94-0, SCHEMBL91511, 5-ethyl-2-trifluoromethylpyridine, SMZCIFQBUAWRNQ-UHFFFAOYSA-N, 5-ethyl-2-trifluoromethyl-pyridine, MFCD19689817, ZINC78373563, DS-9152, FCH1193025, Pyridine, 5-ethyl-2-(trifluoromethyl)-, AK149399, AJ-122727, AX8286675,

Complexity	144
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	175.061g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	175.154g/mol
Monoisotopic Mass	175.061g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	12.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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