AG0039RY

647-42-7 | 2-(Perfluorohexyl) Ethyl Alcohol

AG0039RY

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CAS Number	647-42-7
Catalog Number	AG0039RY(AGN-PC-0JL93A)
Chemical Name	2-(Perfluorohexyl) Ethyl Alcohol
EC Number	211-477-1
IUPAC Name	3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctan-1-ol
InChI	InChI=1S/C8H5F13O/c9-3(10,1-2-22)4(11,12)5(13,14)6(15,16)7(17,18)8(19,20)21/h22H,1-2H2
InChI Key	GRJRKPMIRMSBNK-UHFFFAOYSA-N
MDL Number	MFCD00042143
Molecular Formula	C8H5F13O
Molecular Weight	364.1039
SMILES	FC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(CCO)F
UNII	G2R5YO5N3V
Synonyms	1122-FTOH cpd, 1H,1H,2H,2H-perfluorooctan-1-ol, 647-42-7, 3,3,4,4,5,5,6,6,7,7,8,8,8-Tridecafluorooctan-1-ol, 3,3,4,4,5,5,6,6,7,7,8,8,8-Tridecafluoro-1-octanol, 2-(Perfluorohexyl)ethanol, 1H,1H,2H,2H-Perfluoro-1-octanol, 1H,1H,2H,2H-Perfluorooctan-1-ol, 1H,1H,2H,2H-Perfluorooctanol, UNII-G2R5YO5N3V, 1-Octanol, 3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluoro-, 1H,1H,2H,2H-Tridecafluoro-1-n-octanol, MFCD00042143, G2R5YO5N3V, GRJRKPMIRMSBNK-UHFFFAOYSA-N, AK115542, EINECS 211-477-1, 1,1,2,2-Tetrahydroperfluoro-1-octanol, AC1Q4HVL, ACMC-1B1KO, EC 211-477-1, AC1L2C3H, C6F13CH2CH2OH, DSSTox_CID_24572, DSSTox_RID_80321, DSSTox_GSID_44572, SCHEMBL63212, CHEMBL3181857, DTXSID5044572, CTK5E5905, 2-(Perfluorohexyl) Ethyl Alcohol, 2-(Perfluorohex-1-yl)ethan-1-ol, ZX-AP004902, Tox21_300519, FD2086, KM0878, PC6147, ZINC95719233, AKOS005063801, CS-W002199, DS-4125, RTR-022138, NCGC00248081-01, NCGC00254434-01, AN-47083, CAS-647-42-7, AB1011036, AX8058466, DB-054726, ST2417206, 1H,1H,2H,2H-Perfluoro-1-octanol, 97%, FT-0608930, T2528, 1H,1H,2H,2H-Tridecafluorooctan-1-ol 97+%, A834872, C-36812, I14-19440, 3,3,4,4,5,5,6,6,7,7,8,8,8-tridecakis(fluoranyl)octan-1-ol, Silane,trichloro(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)-, 1122-FTOH cpd, 370533_ALDRICH, C8H5F13O, C8-H5-F13-O, CID69537, AR-1E8337, 1H,1H,2H,2H-Tridecafluoro-1-octanol, 1H,1H,2H,2H-Perfluorooctanol, 97% 10g, C508406, 1H,1H,2H,2H-Perfluorooctan-1-ol, 97% - 100G 100g, 78560-45-9, 83008-59-7,

Complexity	395
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	364.013g/mol
Formal Charge	0
Heavy Atom Count	22
Hydrogen Bond Acceptor Count	14
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	364.106g/mol
Monoisotopic Mass	364.013g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	20.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3
Hazard statements	H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P305+P351+P338
UN Code	UN 1993

Certificate of Analysis

Lot Number