AG008XB5

1060814-58-5 | 3-(Chloromethyl)-2-(trifluoromethyl)pyridine

AG008XB5

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CAS Number	1060814-58-5
Catalog Number	AG008XB5(AGN-PC-09RY29)
Chemical Name	3-(Chloromethyl)-2-(trifluoromethyl)pyridine
IUPAC Name	3-(chloromethyl)-2-(trifluoromethyl)pyridine
InChI	InChI=1S/C7H5ClF3N/c8-4-5-2-1-3-12-6(5)7(9,10)11/h1-3H,4H2
InChI Key	DWOQJLJLLCVGTF-UHFFFAOYSA-N
MDL Number	MFCD10698575
Molecular Formula	C7H5ClF3N
Molecular Weight	195.5695
SMILES	C1=CC(=C(N=C1)C(F)(F)F)CCl
Synonyms	3-(CHLOROMETHYL)-2-(TRIFLUOROMETHYL)PYRIDINE, 1060814-58-5, 3-chloromethyl-2-(trifluoromethyl)pyridine, SCHEMBL738750, DTXSID10697248, DWOQJLJLLCVGTF-UHFFFAOYSA-N, MFCD10698575, ZINC91301438, AKOS006303428, AB62439, 3-Chloromethyl-2-trifluoromethylpyridine, AC-28913, AS-50097, SC-60298, AJ-129664,

Complexity	148
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	195.006g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	195.569g/mol
Monoisotopic Mass	195.006g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	12.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H302-H314
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338-P310
UN Code	UN 1760

Certificate of Analysis

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