AG002C81

1996-23-2 | 1,2-Benzenediol, 3,4,5,6-tetrafluoro-

AG002C81

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CAS Number	1996-23-2
Catalog Number	AG002C81(AGN-PC-0KKZ6N)
Chemical Name	1,2-Benzenediol, 3,4,5,6-tetrafluoro-
IUPAC Name	3,4,5,6-tetrafluorobenzene-1,2-diol
InChI	InChI=1S/C6H2F4O2/c7-1-2(8)4(10)6(12)5(11)3(1)9/h11-12H
InChI Key	AQSZAISVBFUJQG-UHFFFAOYSA-N
MDL Number	MFCD01075279
Molecular Formula	C6H2F4O2
Molecular Weight	182.0725
SMILES	OC1=C(F)C(F)=C(F)C(F)=C1O
Synonyms	1996-23-2, 3,4,5,6-Tetrafluorobenzene-1,2-diol, Tetrafluoro-1,2-benzenediol, TETRAFLUOROBENZENE-1,2-DIOL, TETRAFLUOROCATECHOL, 3,4,5,6-tetrafluoro-1,2-benzenediol, EC-000.1816, tetrafluoropyrocatechol, AC1MCU8V, SCHEMBL986098, CTK4E2849, DTXSID00381169, ZINC2572594, ZX-AP005740, ANW-45616, FCH917890, MFCD01075279, PC9657, SBB089852, AKOS005064117, 1,2-Benzenediol,3,4,5,6-tetrafluoro-, AJ-42052, AS-34999, CC-34868, SC-46534, 1,2-Benzenediol, 3,4,5,6-tetrafluoro-, 1,2-Dihydroxy-3,4,5,6-tetrafluorobenzene, DB-007910, ST2404567, TR-009281, FT-0633959, W4220, A20728, Y-9725, C-06913, 3S101995, I01-14954, C6H2F4O2, ZINC02572594, CID2778870,

Complexity	150
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	181.999g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	182.074g/mol
Monoisotopic Mass	181.999g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	40.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H302-H315-H320-H335
Precuationary statements	P264-P270-P301+P312-P330
Siginal words

Certificate of Analysis

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