AG003B2V

433-06-7 | 2,2,2-Trifluoroethyl 4-methylbenzenesulfonate

AG003B2V

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CAS Number	433-06-7
Catalog Number	AG003B2V(AGN-PC-0OAEJZ)
Chemical Name	2,2,2-Trifluoroethyl 4-methylbenzenesulfonate
EC Number	207-085-5
IUPAC Name	2,2,2-trifluoroethyl 4-methylbenzenesulfonate
InChI	InChI=1S/C9H9F3O3S/c1-7-2-4-8(5-3-7)16(13,14)15-6-9(10,11)12/h2-5H,6H2,1H3
InChI Key	IGKCQDUYZULGBM-UHFFFAOYSA-N
MDL Number	MFCD00000443
Molecular Formula	C9H9F3O3S
Molecular Weight	254.2262
NSC Number	77401
SMILES	O=S(C1=CC=C(C)C=C1)(OCC(F)(F)F)=O
Synonyms	433-06-7, 2,2,2-Trifluoroethyl 4-methylbenzenesulfonate, 2,2,2-Trifluoroethyl p-toluenesulfonate, 2,2,2-Trifluoroethyl tosylate, Trifluoroethanol tosylate, trifluorethyltosylate, 2,2,2-trifluoroethyl-p-toluenesulfonate, Ethanol, 2,2,2-trifluoro-, 4-methylbenzenesulfonate, 2,2,2-Trifluoroethyl p-toluenesulphonate, Ethanol, 2,2,2-trifluoro-, p-toluenesulfonate, IGKCQDUYZULGBM-UHFFFAOYSA-N, p-Toluenesulfonic Acid 2,2,2-Trifluoroethyl Ester, MFCD00000443, Ethanol, 2,2,2-trifluoro-, 1-(4-methylbenzenesulfonate), 2,2,2-trifluoroethyl 4-toluenesulphonate, 2,2,2-trifluoroethyl 4-methylbenzene-1-sulfonate, toluene-4-sulfonic acid 2,2,2-trifluoro-ethyl ester, NSC77401, EINECS 207-085-5, NSC 77401, trifluoroethyl tosylate, CF3CH2OTs, PubChem22367, ACMC-209jtp, AC1Q2LQK, AC1Q4KCZ, AC1L28OK, 2,2-Trifluoroethyl tosylate, NCIOpen2_003878, SCHEMBL68796, KSC237O7B, 2,2,2-Trifluoroethyltosylate, Trifluoroethyl p-toluenesulfonate, 2,2,2-trifluoro-ethyl tosylate, CTK1D7770, IGKCQDUYZULGBM-UHFFFAOYSA-, trifluoroethyl toluene-4-sulfonate, ACT03807, KS-000010GN, ZINC1713407, ANW-29963, CT-656, NSC-77401, SBB101391, AKOS003242104, MCULE-2106947908, RTR-033597, VF10273, 2,2,2-trifluoroethyl-p-toluensulfonate, 2,2,2-Trifluoroethyl 4-toluenesulfonate, 2,2,2-trifluoroethyl-4-toluenesulfonate, 2,2,2-trifluoroethyl4-toluenesulphonate, 2,2,2-trifluoroethyl-4-toluenesulphonate, 2,2,2-trifluoroethyl-p-toluene sulfonate, 2,2,2-trifluoroethyl-p-toluenesulphonate, AC-25712, AJ-30816, AN-44864, CJ-29057, SC-44441, 2,2,2-trifluoroethyl-p-toluene-sulphonate, 2,2,2-trifluoroethyl 4-toluenesulphonate-, 2,2,2-trifluoroethyl para-toluenesulfonate, AB1005595, Ethanol,2,2-trifluoro-, p-toluenesulfonate, ST2415574, TR-033597, AM20040468, FT-0609040, ST45025461, 2,2,2-trifluoroethyl-4-methylbenzenesulfonate, EN300-30885, 2,2,2-Trifluoro-ethano4-methylbenzenesulfonate, 2,2,2-Trifluoroethyl p-toluenesulfonate, 99%, 2,2,2-trifluoroethyl-4-methylbenzenesulphonate, A24546, K-8904, 2,2,2-trifluoroethyl (4-methylphenyl)sulfonate, 2,2,2-Trifluoroethyl 4-methylbenzenesulfonate #, 2,2,2-trifluoroethyl-(4-methylphenyl)sulfonate, 12N-747, 2,2,2-trifluoroethyl-4-methylbenzene-1-sulfonate, A827146, Ethanol,2,2-trifluoro-, 4-methylbenzenesulfonate, 2,2,2-tris(fluoranyl)ethyl 4-methylbenzenesulfonate, p-toluene sulfonic acid-2,2,2-trifluoroethyl ester, p-Toluenesulfonic acid; 2,2,2-trifluoroethyl ester, Z45525852, 4-methylbenzenesulfonic acid 2,2,2-trifluoroethyl ester, Ethanol, 2,2,2-trifluoro-, p-toluenesulfonate (8CI), InChI=1/C9H9F3O3S/c1-7-2-4-8(5-3-7)16(13,14)15-6-9(10,11)12/h2-5H,6H2,1H3, C9H9F3O3S, C9-H9-F3-O3-S, CID67942, AR-1D0387, T1516, 2,2,2-trifluoro-ethanol 4-methylbenzenesulfonate, 2,2,2-Trifluoroethyl p-toluenesulfonate, 98% - 100G 100g, 4707-32-8,

Complexity	310
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	254.022g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	254.223g/mol
Monoisotopic Mass	254.022g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	51.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.6

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