AG00BDB4

26792-49-4 | 3-Bromo-2,6-dihydroxybenzoic acid

AG00BDB4

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CAS Number	26792-49-4
Catalog Number	AG00BDB4(AGN-PC-0KWPU4)
Chemical Name	3-Bromo-2,6-dihydroxybenzoic acid
IUPAC Name	3-bromo-2,6-dihydroxybenzoic acid
InChI	InChI=1S/C7H5BrO4/c8-3-1-2-4(9)5(6(3)10)7(11)12/h1-2,9-10H,(H,11,12)
InChI Key	GPCLJSXGFAOJQE-UHFFFAOYSA-N
MDL Number	MFCD03788827
Molecular Formula	C7H5BrO4
Molecular Weight	233.0162
SMILES	O=C(O)C1=C(O)C=CC(Br)=C1O
Synonyms	3-bromo-2,6-dihydroxybenzoic acid, 26792-49-4, AC1MTF2Q, 3-Bromo-|A-resorcylic Acid, SCHEMBL6494516, CTK4F8529, DTXSID20393784, ZINC2510861, MFCD03788827, AKOS027422541, FCH1335399, Benzoic acid, 3-bromo-2,6-dihydroxy-, AK473707, DS-18861, FT-0663710, 3-Bromo-2,6-dihydroxybenzoic acid, AldrichCPR, J-016549, 3-bromo-2,6-dihydroxy-benzoic Acid, CID3574548,

Complexity	184
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	231.937g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	233.017g/mol
Monoisotopic Mass	231.937g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	77.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

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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