AG0025FR

17763-67-6 | Methanesulfonic acid, 1,1,1-trifluoro-, phenyl ester

AG0025FR

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CAS Number	17763-67-6
Catalog Number	AG0025FR(AGN-PC-0JSPNI)
Chemical Name	Methanesulfonic acid, 1,1,1-trifluoro-, phenyl ester
IUPAC Name	phenyl trifluoromethanesulfonate
InChI	InChI=1S/C7H5F3O3S/c8-7(9,10)14(11,12)13-6-4-2-1-3-5-6/h1-5H
InChI Key	GRJHONXDTNBDTC-UHFFFAOYSA-N
MDL Number	MFCD00192399
Molecular Formula	C7H5F3O3S
Molecular Weight	226.1730
SMILES	FC(S(=O)(=O)OC1=CC=CC=C1)(F)F
Synonyms	Phenyl trifluoromethanesulfonate, 17763-67-6, Phenyl triflate, Methanesulfonic acid, trifluoro-, phenyl ester, GRJHONXDTNBDTC-UHFFFAOYSA-N, AC1LC67Y, phenyltrifluoromethanesulfonate, SCHEMBL780030, ACMC-1C799, CTK4D6546, DTXSID40338354, Phenyl trifluoromethanesulfonate #, ANW-22885, MFCD00192399, Phenyl trifluoromethanesulfonate, 98%, AKOS025213101, ZINC100010867, FCH1318884, FS-4226, AK176204, PC450234, Trifluoromethanesulfonic Acid Phenyl Ester, trifluoro-methanesulfonic acid phenyl ester, TC-111630, P1829, J-011301, I14-60515, Methanesulfonic acid, 1,1,1-trifluoro-, phenyl ester, Methanesulfonic acid,1,1,1-trifluoro-, phenyl ester, CID548641, Phenyl trifluoromethanesulfonate 100g, ACN-041963, Phenyl trifluoromethanesulfonate, 98% - 25G 25g,

Complexity	272
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	225.991g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	226.169g/mol
Monoisotopic Mass	225.991g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	51.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H301-H311-H314
Precuationary statements	P280-P305+P351+P338-P310
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Certificate of Analysis

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