AG0000JX

1000342-93-7 | 1H-Indole, 4-broMo-6-(trifluoroMethyl)-

AG0000JX

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CAS Number	1000342-93-7
Catalog Number	AG0000JX(AGN-PC-04Q5ZS)
Chemical Name	1H-Indole, 4-broMo-6-(trifluoroMethyl)-
IUPAC Name	4-bromo-6-(trifluoromethyl)-1H-indole
InChI	InChI=1S/C9H5BrF3N/c10-7-3-5(9(11,12)13)4-8-6(7)1-2-14-8/h1-4,14H
InChI Key	GVQHXKQOACYLJU-UHFFFAOYSA-N
MDL Number	MFCD09026955
Molecular Formula	C9H5BrF3N
Molecular Weight	264.0419
SMILES	FC(C1=CC2=C(C(Br)=C1)C=CN2)(F)F
Synonyms	4-Bromo-6-(trifluoromethyl)-1H-indole, 1000342-93-7, AK119742, 1H-Indole, 4-bromo-6-(trifluoromethyl)-, 6-Trifluoromethyl-4-bromoindole, 1H-Indole,4-bromo-6-(trifluoromethyl)-, SCHEMBL2426077, DTXSID80646642, GVQHXKQOACYLJU-UHFFFAOYSA-N, KS-000005QU, 6-(Trifluoromethyl)-4-bromo indole, 0051AA, CT-200, ZINC14985717, 4-broMo-6-trifluoroMethyl-1H indole, AKOS016010914, DS-5736, FCH1390229, QC-2935, SB13950, 4-Bromo-6-(trifluoromethyl) 1H indole, DA-39838, AB0095398, AX8245158, CS-0041318, FT-0744897, ST24043453, W-1165, C9H5BrF3N, AJ-66405,

Complexity	219
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	262.95575g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	264.04g/mol
Monoisotopic Mass	262.95575g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	15.8Ų
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H317
Packing Group
Precautionary statements	P280
UN Code

Certificate of Analysis

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