AG0079F0

1133116-49-0 | 3,6-Dibromopicolinic acid

AG0079F0

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CAS Number	1133116-49-0
Catalog Number	AG0079F0(AGN-PC-0WA7UE)
Chemical Name	3,6-Dibromopicolinic acid
IUPAC Name	3,6-dibromopyridine-2-carboxylic acid
InChI	InChI=1S/C6H3Br2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)
InChI Key	YHHZRFKRFAFHRJ-UHFFFAOYSA-N
MDL Number	MFCD11855997
Molecular Formula	C6H3Br2NO2
Molecular Weight	280.9015
SMILES	O=C(O)C1=NC(Br)=CC=C1Br
Synonyms	3,6-Dibromopicolinic acid, 1133116-49-0, 3,6-DIBROMO-2-PYRIDINECARBOXYLIC ACID, 3,6-DIBROMOPYRIDINE-2-CARBOXYLIC ACID, ACMC-2099jj, SCHEMBL19715486, CTK4A8258, DTXSID10675046, ANW-16637, MFCD11855997, ZINC38537524, AKOS015835149, AB64851, RTR-002592, KS-00000Q02, AJ-96157, AK-92200, DS-17593, TR-002592, CS-0030478, ST24022493, Z7473, A-5025, I04-1757, C6H3Br2NO2, ACN-056309, N/A,

Complexity	165
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	280.851g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	280.903g/mol
Monoisotopic Mass	278.853g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	50.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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