AG007AYL

1113049-90-3 | 6-Chloro-5-(trifluoromethyl)nicotinaldehyde

AG007AYL

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CAS Number	1113049-90-3
Catalog Number	AG007AYL(AGN-PC-0CWI7Q)
Chemical Name	6-Chloro-5-(trifluoromethyl)nicotinaldehyde
IUPAC Name	6-chloro-5-(trifluoromethyl)pyridine-3-carbaldehyde
InChI	InChI=1S/C7H3ClF3NO/c8-6-5(7(9,10)11)1-4(3-13)2-12-6/h1-3H
InChI Key	IPROARAVDNVOJZ-UHFFFAOYSA-N
MDL Number	MFCD18258310
Molecular Formula	C7H3ClF3NO
Molecular Weight	209.5530
SMILES	O=CC1=CN=C(Cl)C(C(F)(F)F)=C1
Synonyms	6-Chloro-5-(trifluoromethyl)nicotinaldehyde, 1113049-90-3, 2-Chloro-3-trifluoromethylpyridine-5-carboxaldehyde, 6-CHLORO-5-(TRIFLUOROMETHYL)-3-PYRIDINECARBOXALDEHYDE, SCHEMBL11922597, CTK8C2349, DTXSID10731934, ANW-68235, MFCD18258310, ZINC85223677, AKOS016006933, AB75217, FCH1365968, AC-29075, AK-80565, AJ-127274, AX8237471, DB-060081, TC-156980, CS-0044880, FT-0697315, ST24045300, 6-CHLORO-5-(TRIFLUOROMETHYL)PYRIDINE-3-CARBALDEHYDE,

Complexity	197
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	208.986g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	209.552g/mol
Monoisotopic Mass	208.986g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	30A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number