AG0033BT

864230-02-4 | 2-Fluorophenylsulfur Pentafluoride

AG0033BT

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CAS Number	864230-02-4
Catalog Number	AG0033BT(AGN-PC-0WNU4L)
Chemical Name	2-Fluorophenylsulfur Pentafluoride
IUPAC Name	pentafluoro-(2-fluorophenyl)-λ6-sulfane
InChI	InChI=1S/C6H4F6S/c7-5-3-1-2-4-6(5)13(8,9,10,11)12/h1-4H
InChI Key	MHUHQWYOEMJKBC-UHFFFAOYSA-N
MDL Number	MFCD18909664
Molecular Formula	C6H4F6S
Molecular Weight	222.1514
SMILES	FC1=C(C=CC=C1)S(F)(F)(F)(F)F
Synonyms	864230-02-4, 2-Fluorophenylsulfur Pentafluoride, o-Fluorophenylsulfurpentafluoride, 2-Fluorophenylsulphur pentafluoride, ACMC-20anua, SCHEMBL942753, 2-FluorophenylsulfurPentafluoride, CTK8C6038, DTXSID80479194, MHUHQWYOEMJKBC-UHFFFAOYSA-N, ZX-AP002260, 1-Fluoro-2-(pentafluorothio)benzene, MFCD18909664, ZINC100042561, FCH1347829, PC49115, 1-Fluoro-2-(pentafluorothio(VI))benzene, PS-11541, TC-170569, F0823, J3.589.181A, KS-00001627, 1-fluoro-2-(pentafluoro-$l^{6}-sulfanyl)benzene, 1-fluoro-2-(pentafluoro-lambda6-sulfanyl)benzene,

Complexity	205
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	221.994g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	222.148g/mol
Monoisotopic Mass	221.994g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	5.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3
Hazard statements	H226-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P210-P233-P240-P241-P242-P243-P260-P261-P264-P271-P280-P302+P352-P303+P361+P353-P304-P304+P340-P305+P351+P338-P312-P321-P332+P313-P337+P313-P340-P362-P370+P378-P403-P403+P233-P403+P235-P405-P501
UN Code	UN 1993

Certificate of Analysis

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