AG008Z25

1186404-60-3 | 5-Chloro-6-(trifluoromethyl)-1H-indole

AG008Z25

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CAS Number	1186404-60-3
Catalog Number	AG008Z25(AGN-PC-0N7VWT)
Chemical Name	5-Chloro-6-(trifluoromethyl)-1H-indole
IUPAC Name	5-chloro-6-(trifluoromethyl)-1H-indole
InChI	InChI=1S/C9H5ClF3N/c10-7-3-5-1-2-14-8(5)4-6(7)9(11,12)13/h1-4,14H
InChI Key	VLLFFZSKKBGBRG-UHFFFAOYSA-N
MDL Number	MFCD03094972
Molecular Formula	C9H5ClF3N
Molecular Weight	219.5909
SMILES	FC(C1=CC2=C(C=C1Cl)C=CN2)(F)F
Synonyms	5-chloro-6-(trifluoromethyl)-1H-indole, 1186404-60-3, chlorotrifluoromethylindole, CTK6G7245, DTXSID30442772, 5-chloro-6-(trifluoromethyl)indole, KS-00001Q4F, ZX-AP011150, 0631AD, MFCD03094972, SBB095834, ZINC39119354, AKOS005072933, FCH1334748, GD-0016, MCULE-2625760887, RP12703, AJ-98523, PC200217, SC-36246, AX8201541, TR-064914, C9H5ClF3N, CID10632688,

Complexity	219
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	219.006g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	219.591g/mol
Monoisotopic Mass	219.006g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	15.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.6

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

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