AG0039FX

215867-87-1 | 2-(chloromethyl)-4-(trifluoromethyl)pyridine

AG0039FX

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CAS Number	215867-87-1
Catalog Number	AG0039FX(AGN-PC-01UYJ8)
Chemical Name	2-(chloromethyl)-4-(trifluoromethyl)pyridine
IUPAC Name	2-(chloromethyl)-4-(trifluoromethyl)pyridine
InChI	InChI=1S/C7H5ClF3N/c8-4-6-3-5(1-2-12-6)7(9,10)11/h1-3H,4H2
InChI Key	KAGAMWQQBRRVBH-UHFFFAOYSA-N
MDL Number	MFCD10697599
Molecular Formula	C7H5ClF3N
Molecular Weight	195.5695
SMILES	ClCC1=NC=CC(=C1)C(F)(F)F
Synonyms	2-(chloromethyl)-4-(trifluoromethyl)pyridine, 215867-87-1, 2-chloromethyl-4-(trifluoromethyl)pyridine, PYRIDINE, 2-(CHLOROMETHYL)-4-(TRIFLUOROMETHYL)-, SCHEMBL1843485, KS-00001PVB, DTXSID00593109, KAGAMWQQBRRVBH-UHFFFAOYSA-N, 7334AD, MFCD10697599, ZINC72003368, AKOS006304604, AB60026, AG-0707, RP11533, 2-chloromethyl-4-trifluoromethylpyridine, AK138041, AJ-119025, J-506292, C7H5ClF3N,

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	6.1
Hazard statements	H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P305+P351+P338
UN Code	UN 2811

Certificate of Analysis

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