AG00C1TQ

31224-82-5 | 5-Trifluoromethyl-pyridine-2-carbaldehyde

AG00C1TQ

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CAS Number	31224-82-5
Catalog Number	AG00C1TQ(AGN-PC-001DN9)
Chemical Name	5-Trifluoromethyl-pyridine-2-carbaldehyde
IUPAC Name	5-(trifluoromethyl)pyridine-2-carbaldehyde
InChI	InChI=1S/C7H4F3NO/c8-7(9,10)5-1-2-6(4-12)11-3-5/h1-4H
InChI Key	JJDDVGAESNBKMY-UHFFFAOYSA-N
MDL Number	MFCD07375388
Molecular Formula	C7H4F3NO
Molecular Weight	175.1080
SMILES	FC(F)(F)C1=CC=C(C=O)N=C1
Synonyms	31224-82-5, 5-(TRIFLUOROMETHYL)PICOLINALDEHYDE, 5-(Trifluoromethyl)-2-pyridinecarboxyaldehyde, 5-(Trifluoromethyl)pyridine-2-carboxaldehyde, 5-Trifluoromethyl-pyridine-2-carbaldehyde, 5-(trifluoromethyl)pyridine-2-carbaldehyde, MFCD07375388, 2-Pyridinecarboxaldehyde,5-(trifluoromethyl)-, 5-(Trifluoromethyl)-pyridine-2-carboxaldehyde, SCHEMBL472513, 5-Trifluoromethylpicolinealdehyde, CTK4G6576, DTXSID60560115, 5-Trifluoromethylpicoline aldehyde, JJDDVGAESNBKMY-UHFFFAOYSA-N, KS-00000JW3, BBL100749, SBB089006, STL554543, WT1992, ZINC19738649, AKOS005255360, AB41847, CS-W008800, RP02891, VP11195, AC-29116, AJ-74814, AK-29682, BC684786, DS-11249, QC-10316, SC-30077, SC-32622, SY040938, AB0040989, ST2418588, TR-013288, 4CH-012596, FT-0678614, Y8674, MFCD07375388 (95%), 2-Pyridinecarboxaldehyde, 5-(trifluoromethyl)-, Z-1842, I02-4710, J-516453, 31224-82-5 5-Trifluoromethyl-pyridine-2-carbaldehyde, C7H4F3NO, C2286,

Complexity	169
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	175.024g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	175.11g/mol
Monoisotopic Mass	175.024g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	30A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H227-H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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