AG003S1U

36919-03-6 | Methyl Pentafluorophenyl Carbonate

AG003S1U

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CAS Number	36919-03-6
Catalog Number	AG003S1U(AGN-PC-000NWF)
Chemical Name	Methyl Pentafluorophenyl Carbonate
IUPAC Name	methyl (2,3,4,5,6-pentafluorophenyl) carbonate
InChI	InChI=1S/C8H3F5O3/c1-15-8(14)16-7-5(12)3(10)2(9)4(11)6(7)13/h1H3
InChI Key	HGYOVHMDBHQLOE-UHFFFAOYSA-N
MDL Number	MFCD01075723
Molecular Formula	C8H3F5O3
Molecular Weight	242.0996
SMILES	O=C(OC)OC1=C(F)C(F)=C(F)C(F)=C1F
Synonyms	METHYL PENTAFLUOROPHENYL CARBONATE, 36919-03-6, pentafluorophenyl methyl carbonate, MFCD01075723, METHYL (PERFLUOROPHENYL) CARBONATE, Carbonic acid, methyl pentafluorophenyl ester, ACMC-20akf4, SCHEMBL1401584, DTXSID90557159, (Pentafluorophenoxy)(methoxy) ketone, AKOS025213713, ZINC100028766, ACM36919036, AS-42398, SC-90367, TC-166135, Carbonic Acid Methyl Pentafluorophenyl Ester, FT-0628775, M2594, methyl (2,3,4,5,6-pentafluorophenyl) carbonate, I14-101196, 1-bromo-3,3-dimethyl-butan-2-ol,

Complexity	248
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	242g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	242.101g/mol
Monoisotopic Mass	242g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	35.5A^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
Packing Group
Precautionary statements	P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
UN Code

Certificate of Analysis

Lot Number