AG007SDT

112725-89-0 | 3，5-Diamino-2-hydroxybenzoic acid

AG007SDT

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CAS Number	112725-89-0
Catalog Number	AG007SDT(AGN-PC-0NKXBG)
Chemical Name	3，5-Diamino-2-hydroxybenzoic acid
EC Number	601-199-2
IUPAC Name	3,5-diamino-2-hydroxybenzoic acid
InChI	InChI=1S/C7H8N2O3/c8-3-1-4(7(11)12)6(10)5(9)2-3/h1-2,10H,8-9H2,(H,11,12)
InChI Key	HQURVGSRQBOZEX-UHFFFAOYSA-N
MDL Number	MFCD09753462
Molecular Formula	C7H8N2O3
Molecular Weight	168.1500
SMILES	O=C(O)C1=CC(N)=CC(N)=C1O
Synonyms	3,5-diamino-2-hydroxybenzoic acid, 112725-89-0, 3,5-Diaminosalicylic acid, 3,5-diamino-2-hydroxy-benzoic acid, Benzoic acid,3,5-diamino-2-hydroxy-, Benzoic acid, 3,5-diamino-2-hydroxy-, AK113396, ACMC-1BQ00, SCHEMBL2192034, (non-HCl)Mesalamine Impurity J, CTK4A7938, DTXSID90578304, HQURVGSRQBOZEX-UHFFFAOYSA-N, KS-00000I9A, 2213AA, BBL102606, FCH870001, MFCD09753462, STL556409, ZINC34744044, AKOS006329455, AC-7851, AN-8599, CS-W005520, DS-6261, LS10764, 3,5-bis(azanyl)-2-oxidanyl-benzoic acid, AJ-90042, SC-20504, AB0070058, AX8165696, ST2404616, 4CH-002987, FT-0658967, 725D890, A802638, I01-6387, C7H8N2O3, 3,5-diamino-2-hydroxybenzoicacid,

Complexity	186
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	168.053g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	4
Isotope Atom Count	0
Molecular Weight	168.152g/mol
Monoisotopic Mass	168.053g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	110A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.3

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number