AG003NC9

391-12-8 | 7-(Trifluoromethyl)indoline-2,3-dione

AG003NC9

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CAS Number	391-12-8
Catalog Number	AG003NC9(AGN-PC-0JTNHW)
Chemical Name	7-(Trifluoromethyl)indoline-2,3-dione
IUPAC Name	7-(trifluoromethyl)-1H-indole-2,3-dione
InChI	InChI=1S/C9H4F3NO2/c10-9(11,12)5-3-1-2-4-6(5)13-8(15)7(4)14/h1-3H,(H,13,14,15)
InChI Key	MXLDJTXXAYVWDF-UHFFFAOYSA-N
MDL Number	MFCD00001230
Molecular Formula	C9H4F3NO2
Molecular Weight	215.1288
SMILES	C1=CC=C(C2=C1C(=O)C(N2)=O)C(F)(F)F
Synonyms	7-trifluoromethylisatin, 391-12-8, 7-Trifluoromethylisatin, 7-(Trifluoromethyl)isatin, 7-(Trifluoromethyl)indoline-2,3-dione, 7-(Trifluoromethyl)-1H-indole-2,3-dione, 7-trifluoromethyl-1h-indole-2,3-dione, 7-(trifluoromethyl)-2,3-dihydro-1h-indole-2,3-dione, MXLDJTXXAYVWDF-UHFFFAOYSA-N, 1H-INDOLE-2,3-DIONE, 7-(TRIFLUOROMETHYL)-, MFCD01248408, 7-(trifluoromethyl)-1~{H}-indole-2,3-dione, 7-Trifluoroisatin, PubChem9557, AC1LCPWB, 7-trifluoromethyl-isatin, ACMC-1CLGD, AC1Q4IR6, Isatin-based compound, 45, KSC493C7F, SCHEMBL594546, CHEMBL376435, Jsp006801, BDBM22825, CTK3J3172, KS-00000DIR, DTXSID70345455, ACT06684, ALBB-014432, BCP05930, ZINC2487385, 7-trifluoromethylindoline-2,3-dione, ANW-29018, SBB095071, 7-(Trifluoromethyl)indole-2,3-dione, 7-trifluoromethyl indoline-2,3-dione, 7-(trifluoromethyl)isatin, AldrichCPR, AKOS000117359, 7-(Trifluoromethyl)-2,3-indolinedione, AB08418, AC-3078, CCG-249437, CM14311, CS-W002752, FS-1804, MCULE-7085583203, RP26895, RTC-020848, TRA0055043, VZ30865, 7-(trifluoromethyl)1h-indole-2,3-dione, AJ-35942, AK-51557, AN-13323, BR-51557, CJ-08434, Q974, SC-26664, SY003780, AB0006364, AB1001737, DB-008497, ST2419054, TC-020848, AM20061059, FT-0632075, 7-(Trifluoromethyl)-1H-indole-2,3-dione #, EN300-10741, T-6392, MFCD01248408 (97+%), 391T128, J-519335, 7-(trifluoromethyl)-1H-benzo[d]azolidine-2,3-dione, Z56855139, null, 7- indoline-2,3-dione, D0E5ZP, 7-(Trifluoromethyl)-isatin, Tetrahydro-4H-pyran-4-one, C9H4F3NO2, CID604575, T2457, B-3370, 29943-42-8,

Complexity	313
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	215.019g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	215.131g/mol
Monoisotopic Mass	215.019g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	46.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number