AG00AKMP

1548-84-1 | Benzoic acid pentafluorophenyl ester, BzOPfp

AG00AKMP

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CAS Number	1548-84-1
Catalog Number	AG00AKMP(AGN-PC-0O4EYA)
Chemical Name	Benzoic acid pentafluorophenyl ester, BzOPfp
IUPAC Name	(2,3,4,5,6-pentafluorophenyl) benzoate
InChI	InChI=1S/C13H5F5O2/c14-7-8(15)10(17)12(11(18)9(7)16)20-13(19)6-4-2-1-3-5-6/h1-5H
InChI Key	WZPWTXZSQHIABL-UHFFFAOYSA-N
MDL Number	MFCD00483755
Molecular Formula	C13H5F5O2
Molecular Weight	288.1696
SMILES	O=C(OC1=C(F)C(F)=C(F)C(F)=C1F)C2=CC=CC=C2
Synonyms	Perfluorophenyl benzoate, Pentafluorophenyl benzoate, 1548-84-1, Benzoic acid pentafluorophenyl ester, BzOPfp, pentafluorophenylbenzoate, SCHEMBL7086238, WZPWTXZSQHIABL-UHFFFAOYSA-N, KS-000017PH, Benzoic acid, pentafluorophenyl ester, MFCD00483755, ZINC100180822, AX8291136, P2229, Pentafluorophenyl benzoate, >=98.0% (HPLC), CID11011649, (2,3,4,5,6-pentafluorophenyl) Benzoate,

Complexity	332
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	288.021g/mol
Formal Charge	0
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	288.173g/mol
Monoisotopic Mass	288.021g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.8

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