AG0025FN

17763-80-3 | Methanesulfonic acid, 1,1,1-trifluoro-, 4-nitrophenyl ester

AG0025FN

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CAS Number	17763-80-3
Catalog Number	AG0025FN(AGN-PC-04X3HC)
Chemical Name	Methanesulfonic acid, 1,1,1-trifluoro-, 4-nitrophenyl ester
IUPAC Name	(4-nitrophenyl) trifluoromethanesulfonate
InChI	InChI=1S/C7H4F3NO5S/c8-7(9,10)17(14,15)16-6-3-1-5(2-4-6)11(12)13/h1-4H
InChI Key	NDTIXHNCNLKURN-UHFFFAOYSA-N
MDL Number	MFCD00192354
Molecular Formula	C7H4F3NO5S
Molecular Weight	271.1706
SMILES	O=S(C(F)(F)F)(OC1=CC=C([N+]([O-])=O)C=C1)=O
Synonyms	4-Nitrophenyl trifluoromethanesulfonate, 17763-80-3, 4-Nitrophenyl triflate, NDTIXHNCNLKURN-UHFFFAOYSA-N, MFCD00192354, 4-Nitrophenyl trifluoromethanesulfonate, 99%, trifluoromethanesulfonic acid 4-nitrophenyl ester, 4-Nitrophenyltriflate, ACMC-20amc8, AC1LC8E3, C7H4F3NO5S, SCHEMBL37687, CTK3J5252, DTXSID60338553, CS-M2922, KS-00001F1B, ZX-AP007159, 5934AD, BBL100134, PC4316, STL511371, ZINC68576474, AKOS003672484, FCH2711290, MCULE-2852751190, RTR-008110, 4-nitrophenyl (trifluoromethyl)sulfonate, (4-nitrophenyl) trifluoromethanesulfonate, CS-14838, 4-Nitrophenyl trifluoromethanesulfonate,99%, TR-008110, FT-0619268, N0993, ST51031614, 1-(Trifluoromethylsulfonyloxy)-4-nitrobenzene, 4-(trifluoromethylsulfonyloxy)-1-nitrobenzene, (4-nitrophenyl) tris(fluoranyl)methanesulfonate, trifluoromethanesulfonic acid 4-nitrophenylester, trifluoromethanesulfonic acid4-nitrophenyl ester, X-4535, A812281, J-011302, trifluoro-methanesulfonic acid (4-nitrophenyl) ester, trifluoromethanesulfonic acid (4-nitrophenyl) ester, I14-29146, Methanesulfonicacid,1,1,1-trifluoro-,4-nitrophenylester, Methanesulfonic acid, 1,1,1-trifluoro-, 4-nitrophenyl ester, CID549870,

Complexity	374
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	270.976g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	271.166g/mol
Monoisotopic Mass	270.976g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	97.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H314
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338-P310
UN Code	UN 3261

Certificate of Analysis

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