AG0038LI

618-58-6 | Benzoicacid, 3,5-dibromo-

AG0038LI

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CAS Number	618-58-6
Catalog Number	AG0038LI(AGN-PC-0JKAE4)
Chemical Name	Benzoicacid, 3,5-dibromo-
IUPAC Name	3,5-dibromobenzoic acid
InChI	InChI=1S/C7H4Br2O2/c8-5-1-4(7(10)11)2-6(9)3-5/h1-3H,(H,10,11)
InChI Key	SFTFNJZWZHASAQ-UHFFFAOYSA-N
MDL Number	MFCD00051758
Molecular Formula	C7H4Br2O2
Molecular Weight	279.9135
SMILES	OC(=O)c1cc(Br)cc(c1)Br
Synonyms	3,5-Dibromobenzoic acid, 618-58-6, BENZOIC ACID, 3,5-DIBROMO-, 3,5-Dibromobenzoicacid, Benzoicacid, 3,5-dibromo-, BRN 1940691, MFCD00051758, BUTTPARK 99\57-19, SFTFNJZWZHASAQ-UHFFFAOYSA-N, 3,5-Dibromobenzoic acid, 99%, PubChem3861, ACMC-209mwz, AC1L1YRF, Maybridge1_003318, 3,5-dibromo-benzoic acid, AC1Q72YL, SCHEMBL8361, 4-09-00-01028 (Beilstein Handbook Reference), KSC358A3H, RARECHEM AL BO 0773, 3,5-Dibromobenzoic acid, 95%, CTK2F8033, HMS550O18, KS-00000CIN, DTXSID60210800, ATTERCOP-CHM AT115943, ZINC142254, ACT00785, CS-M1190, STR06332, ANW-33969, CD-413, SBB052702, AKOS005255111, AB02139, AC-7431, AN-8984, AS03517, CCG-239898, MCULE-9834588123, PS-7239, RP29826, RTR-021275, TRA0097352, AJ-12453, AK-73084, BC002643, BR-73084, LS-36758, Q650, SC-05789, SY006266, AB0017718, AB1000741, DB-022007, ST2410291, TL8003964, TR-021275, A8564, AM20060245, D2353, FT-0081860, FT-0614510, ST45026857, M-1389, MFCD00051758 (97+%), AE-641/00128058, I01-1534, J-511270, InChI=1/C7H4Br2O2/c8-5-1-4(7(10)11)2-6(9)3-5/h1-3H,(H,10,11, null, C7H4Br2O2, C7-H4-Br2-O2, CID12063, ACN-029865, 3,5-Dibromobenzoic acid, 98% - 1G 1g,

Complexity	151
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	279.856g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	279.915g/mol
Monoisotopic Mass	277.858g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
Signal Words	warning
UN Code

Certificate of Analysis

Lot Number