AG003223

3107-98-0 | Hexanedioic acid, 2,2,3,3,4,4,5,5-octafluoro-, 1,6-dimethyl ester

AG003223

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CAS Number	3107-98-0
Catalog Number	AG003223(AGN-PC-0KK8AR)
Chemical Name	Hexanedioic acid, 2,2,3,3,4,4,5,5-octafluoro-, 1,6-dimethyl ester
IUPAC Name	dimethyl 2,2,3,3,4,4,5,5-octafluorohexanedioate
InChI	InChI=1S/C8H6F8O4/c1-19-3(17)5(9,10)7(13,14)8(15,16)6(11,12)4(18)20-2/h1-2H3
InChI Key	XPXVIIILXUOEQA-UHFFFAOYSA-N
MDL Number	MFCD00042267
Molecular Formula	C8H6F8O4
Molecular Weight	318.1181
SMILES	COC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(=O)OC
Synonyms	Dimethyl Octafluoroadipate, 3107-98-0, Dimethyl Perfluoroadipate, Dimethyl 2,2,3,3,4,4,5,5-octafluorohexanedioate, MFCD00042267, Hexanedioic acid, octafluoro-, dimethyl ester, Dimethyloctafluoroadipate, ACMC-1CSON, AC1MC6SZ, Dimethyl Octafluorohexanedioate, SCHEMBL497763, C8H6F8O4, CTK4G6359, DTXSID60371849, PC3015T, XPXVIIILXUOEQA-UHFFFAOYSA-N, Perfluoroadipic Acid Dimethyl Ester, ZINC2168615, ZX-AP005911, Octafluoroadipic Acid Dimethyl Ester, 9827AD, ANW-27029, Dimethyl octafluorohexane-1,6-dioate, AKOS003788953, ACM3107980, FS-4124, VZ31918, Octafluorohexanedioic Acid Dimethyl Ester, CC-26978, DB-047963, TR-013256, D3590, FT-0625091, A820709, C-19541, 1,6-dimethyl 2,2,3,3,4,4,5,5-octafluorohexanedioate, I14-111296, dimethyl 2,2,3,3,4,4,5,5-octakis(fluoranyl)hexanedioate, 2,2,3,3,4,4,5,5-octafluorohexanedioic acid dimethyl ester, Hexanedioic acid, 2,2,3,3,4,4,5,5-octafluoro-, 1,6-dimethyl ester, Hexanedioic acid,2,2,3,3,4,4,5,5-octafluoro-, 1,6-dimethyl ester, Dimethyl octafluoroadipinate, CID2737117,

Complexity	367
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	318.014g/mol
Formal Charge	0
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	12
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	318.119g/mol
Monoisotopic Mass	318.014g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	52.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
UN Code

Certificate of Analysis

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