AG000L5V

123843-57-2 | Benzonitrile, 2,6-difluoro-4-hydroxy-

AG000L5V

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CAS Number	123843-57-2
Catalog Number	AG000L5V(AGN-PC-0KKZ4B)
Chemical Name	Benzonitrile, 2,6-difluoro-4-hydroxy-
IUPAC Name	2,6-difluoro-4-hydroxybenzonitrile
InChI	InChI=1S/C7H3F2NO/c8-6-1-4(11)2-7(9)5(6)3-10/h1-2,11H
InChI Key	KEIYYIGMDPTAPL-UHFFFAOYSA-N
MDL Number	MFCD03094499
Molecular Formula	C7H3F2NO
Molecular Weight	155.1016
SMILES	C(#N)c1c(F)cc(cc1F)O
Synonyms	2,6-Difluoro-4-hydroxybenzonitrile, 123843-57-2, 4-Cyano-3,5-difluorophenol, 3,5-difluoro-4-cyanophenol, 4-hydroxy-2,6-difluorobenzonitrile, 3.5-Difluoro-4-cyanophenol, Benzonitrile, 2,6-difluoro-4-hydroxy-, 2,6-Difluoro-4-hydroxy benzonitrile, 2,6-difluoro-4-hydroxy-benzonitrile, AK-33026, 2,6-difluoro-4-hydroxybenzenecarbonitrile, PubChem5196, ACMC-1BZ2H, AC1MCU11, SCHEMBL81244, KSC495C8F, Jsp001591, CTK3J5182, KS-00000ECQ, DTXSID00381124, KEIYYIGMDPTAPL-UHFFFAOYSA-N, ACT12409, EBD41024, ZINC2243358, ZX-AP011730, 2,6-difluoro-4-hydroxybenzo-nitrile, 4-hydroxy-2,6-difluorobenzonitrile;, ANW-18164, CD-479, DT1121, FCH918255, MFCD03094499, PC8318, SBB063847, AKOS005063555, AB13335, AC-2754, AM61301, AS01699, CM10985, CS-W003007, PF10531, RTC-071269, TRA0074376, VF10026, AJ-34308, AN-13634, BR-33026, CC-18993, CJ-08022, DS-12290, L117, SC-00641, SY002811, AB0014538, AB1005451, AX8010203, BB0295947, DB-023713, ST2403739, TC-071269, C2107, D3424, FT-0602461, A20972, B-6728, MFCD03094499 (97+%), 843C572, C-03404, I01-3083, I01-7629, 4-Cyano-3,5-Difluorophenol/3,5-Difluoro-4-Cyanophenol;Benzonitrile, 2,6-difluoro-4-hydroxy- (9CI), null, C7H3F2NO, ZINC02243358, ACN-032890, CID2778774, Benzonitrile, 2,6-difluoro-4-hydroxy- (9CI),

Complexity	176
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	155.018g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	155.104g/mol
Monoisotopic Mass	155.018g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	44A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H301-H311-H315-H319-H332-H335
Packing Group	Ⅲ
Precautionary statements	P261-P280-P305+P351+P338-P311
UN Code	UN 3439

Certificate of Analysis

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