AG00111K

132715-69-6 | Benzoic acid, 2-bromo-3-fluoro-

AG00111K

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CAS Number	132715-69-6
Catalog Number	AG00111K(AGN-PC-0JON7S)
Chemical Name	Benzoic acid, 2-bromo-3-fluoro-
IUPAC Name	2-bromo-3-fluorobenzoic acid
InChI	InChI=1S/C7H4BrFO2/c8-6-4(7(10)11)2-1-3-5(6)9/h1-3H,(H,10,11)
InChI Key	KQRCBMPPEPNNDS-UHFFFAOYSA-N
MDL Number	MFCD01569398
Molecular Formula	C7H4BrFO2
Molecular Weight	219.0079
NSC Number	190303
SMILES	BrC1=C(C(=O)O)C=CC=C1F
Synonyms	2-Bromo-3-fluorobenzoic acid, 132715-69-6, 3-fluoro-2-bromobenzoic acid, Benzoic acid, 2-bromo-3-fluoro-, 2-Bromo-3-fluorobenzoicacid, 2-bromo-3-fluoro-benzoic acid, BUTTPARK 22\01-97, 2-Bromo-3-fluorobenzoic acid, 98%, NSC190303, PubChem1319, 2-bromo-3-fluorobenzoic, ACMC-1C0RE, Intermediates-ZCF02016, KSC174C5P, SCHEMBL394187, 3-fluoro-2-bromo benzoic acid, AC1L70X1, Jsp001983, Benzoicacid, 2-bromo-3-fluoro-, CTK0H4157, KS-00000CCB, DTXSID50307157, KQRCBMPPEPNNDS-UHFFFAOYSA-N, WT005, 2-bromo-3-fluorobenzoic acid 98%, ACT00343, ZINC1732026, ANW-19457, CB-377, MFCD01569398, SBB062989, AKOS005063818, AC-1212, AN-1827, AS00973, CM12486, CS-W001156, DS-0455, LS10584, NSC-190303, PS-7894, RP27155, RTR-004464, TF10419, TRA0079742, VZ23914, AJ-31243, AK-25368, BC002146, BC220217, BR-25368, SC-00808, SY003121, 2-Bromo-3-fluorobenzoic acid, AldrichCPR, AB0008598, DB-008171, ST2416530, TL8000776, TR-004464, AM20060108, B3722, FT-0084974, FT-0601248, 132715-69-6 2-bromo-3-fluorobenzoic acid, C-5896, 715B696, I01-0009, Z1741958086, 3-fluoro-2-bromo benzoic acid 2-bromo-3-fluorobenzoic acid, C7H4BrFO2, CID302622, ACN-046803, A1502, 2-Bromo-3-fluorobenzoic acid, 96% - 1G 1g,

Complexity	163
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	217.938g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	219.009g/mol
Monoisotopic Mass	217.938g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P305+P351+P338
UN Code	UN 2811

Certificate of Analysis

Lot Number