AG00C27S

31181-54-1 | 2-Methyl-5-(trifluoromethyl)pyridine

AG00C27S

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CAS Number	31181-54-1
Catalog Number	AG00C27S(AGN-PC-01UYJA)
Chemical Name	2-Methyl-5-(trifluoromethyl)pyridine
IUPAC Name	2-methyl-5-(trifluoromethyl)pyridine
InChI	InChI=1S/C7H6F3N/c1-5-2-3-6(4-11-5)7(8,9)10/h2-4H,1H3
InChI Key	ZBCOTWQYKCHKQK-UHFFFAOYSA-N
MDL Number	MFCD11100538
Molecular Formula	C7H6F3N
Molecular Weight	161.1244
SMILES	CC1=NC=C(C=C1)C(F)(F)F
Synonyms	2-Methyl-5-(trifluoromethyl)pyridine, 31181-54-1, SCHEMBL27428, CTK4G6509, DTXSID10593110, ZBCOTWQYKCHKQK-UHFFFAOYSA-N, KS-00003KO5, ANW-56207, BBL100877, FCH888182, MFCD11100538, STL554671, ZINC30714873, AKOS005255559, AB63092, FS-2214, AJ-84160, DA-18711, Pyridine, 2-methyl-5-(trifluoromethyl)-, SC-86640, AX8168789, TR-036434, FT-0678631, X3274, Y-8930, A818228, C7H6F3N, 2,2-dimethyl-3,4-dihydro-2H-benzo[e][1,3]oxazine, 261635-98-7,

Complexity	132
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	161.045g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	161.127g/mol
Monoisotopic Mass	161.045g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	12.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number