AG00I66R

326-91-0 | 2-Thenoyltrifluoroacetone

AG00I66R

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CAS Number	326-91-0
Catalog Number	AG00I66R(AGN-PC-0WA74Q)
Chemical Name	2-Thenoyltrifluoroacetone
EC Number	206-316-7
IUPAC Name	4,4,4-trifluoro-1-thiophen-2-ylbutane-1,3-dione
InChI	InChI=1S/C8H5F3O2S/c9-8(10,11)7(13)4-5(12)6-2-1-3-14-6/h1-3H,4H2
InChI Key	TXBBUSUXYMIVOS-UHFFFAOYSA-N
MDL Number	MFCD00005445
Molecular Formula	C8H5F3O2S
Molecular Weight	222.1843
NSC Number	66544
SMILES	C1=CC=C(S1)C(CC(=O)C(F)(F)F)=O
UNII	MYQ9MNW7NI
Synonyms	4,4,4-trifluoro-1-(2-thienyl)-1,3-butanedione, Thenoyltrifluoroacetone, Trifluorothienylacetone, TTFA cpd, 2-Thenoyltrifluoroacetone, 326-91-0, THENOYLTRIFLUOROACETONE, 4,4,4-trifluoro-1-(thiophen-2-yl)butane-1,3-dione, 1,3-Butanedione, 4,4,4-trifluoro-1-(2-thienyl)-, 4,4,4-Trifluoro-1-(2-thienyl)-1,3-butanedione, 4,4,4-Trifluoro-1-(2-thienyl)butane-1,3-dione, Perfluoroacetyl(2-thenoyl)methane, alpha-Thenoyltrifluoroacetone, 1-Thenoyl-3,3,3-trifluoroacetone, .alpha.-Thenoyltrifluoroacetone, UNII-MYQ9MNW7NI, 1,1,1-Trifluoro-3-(2-thenoyl)acetone, 1-(2-Thenoyl)-3,3,3-trifluoroacetone, NSC 66544, 4,4,4-TRIFLUORO-1-THIEN-2-YLBUTANE-1,3-DIONE, MYQ9MNW7NI, EINECS 206-316-7, MFCD00005445, TTB, AI3-31295, TXBBUSUXYMIVOS-UHFFFAOYSA-N, 1-THIENYL-4,4,4-TRIFLUORO-1,3-BUTANEDIONE, 2-(3-Oxo-4,4,4-trifluorobutanoyl)thiophene, 4,4,4-Trifluoro-1[2-thienyl]-1,3-butanedione, Thenoyltrifluoroacetone, 99%, 4,4,4-trifluoro-1-thiophen-2-ylbutane-1,3-dione, 2,4-Dioxo-4-(thien-2-yl)-1,1,1-trifluorobutane, HTTA, thenoyl trifluoroacetone, AC1L1KPN, TTA (EXTRACTANT), 2-thenoyl trifluoroacetone, ACMC-1CM3H, 2-thenoyl trifluoro acetone, SCHEMBL195358, AC1Q4I45, ARONIS021027, Jsp006018, 1-Thenoyl-3,3-trifluoroacetone, 2-Thenoyltrifluoroacetone, 99%, CHEMBL1236433, DTXSID1059812, CTK0I4649, KS-00004CLY, TOS-BB-0669, TXBBUSUXYMIVOS-UHFFFAOYSA-, HMS3604B13, BCP21685, NSC66544, ANW-27410, BBL014250, HSCI1_000376, NSC-66544, SBB003341, STK020843, 1,1-Trifluoro-3-(2-thenoyl)acetone, AKOS000119762, ZINC100004957, AC-4921, CCG-207997, CS-W020091, DB04795, DS-1137, LS40311, MCULE-7481288995, PS-6790, RP27375, RTR-013716, SC11823, TRA0096222, KS-00000C17, 1, 4,4,4-trifluoro-1-(2-thienyl)-, AK-46533, AN-11464, BR-46533, P634, SY004998, DB-001234, LS-166686, ST2410209, TR-013716, 1-(Thenoyl-(2'))-3,3,3-trifluoroacetone, AM20090477, EU-0000019, FT-0613433, ST45034729, MFCD00005445 (98%), 26T910, M-5475, 2-(4,4,4-TRIFLUOROACETOACETYL)THIOPHENE, 1,1,1-TRIFLUORO-3-(2'-THENOYL)ACETONE, 1,3-Butanedione, 4,4,4-trifluoro-1-(thienyl)-, 2-Thenoyltrifluoroacetone, purum, >=97.0% (GC), 4,4,4-Trifluoro-1-(2-thienyl)-1,3-Butanedion, SR-01000388942, I09-0310, Q-200324, SR-01000388942-1, 4,4,4-trifluoro-1-thiophen-2-yl-butane-1,3-dione, BRD-K00959089-001-01-4, Z57201518, 1-THIEN-2-YL-4,4,4-TRIFLUOROBUTANE-1,3-DIONE, 4,4-TRIFLUORO-1-(2-THIENYL)-1,3-BUTANEDIONE, F0346-3664, 4,4,4-TRIFLUORO-1-(2-THENOYL)-1,3-BUTANEDIONE, 2-Thenoyltrifluoroacetone, for spectrophotometric det. of metal ions, >=99.0%, InChI=1/C8H5F3O2S/c9-8(10,11)7(13)4-5(12)6-2-1-3-14-6/h1-3H,4H2, 29463-74-9, ttfa, TTFA cpd, Trifluorothienylacetone, 2-PYRROLIDONE, 2-thenoyltriflouroacetone, C8H5F3O2S, CID5601, C8-H5-F3-O2-S, ACN-051482, 2-Thenoyl Trifluoroacetone 99% AR 10gm, C3272, T0438, 2-Thenoyltrifluoroacetone, 99% - 100G 100g, TTA, D013804, 2-Thenoyltrifluoroacetone, 99% dry weight, may contain up to 2% water 25g, 77611-51-9, TTF,

Complexity	250
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	221.996g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	222.181g/mol
Monoisotopic Mass	221.996g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	62.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number