AG0050HG

84639-84-9 | 7-Hydroxyindole-2-carboxylic acid

AG0050HG

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CAS Number	84639-84-9
Catalog Number	AG0050HG(AGN-PC-02RFXO)
Chemical Name	7-Hydroxyindole-2-carboxylic acid
IUPAC Name	7-hydroxy-1H-indole-2-carboxylic acid
InChI	InChI=1S/C9H7NO3/c11-7-3-1-2-5-4-6(9(12)13)10-8(5)7/h1-4,10-11H,(H,12,13)
InChI Key	RKTALADUQKJJKU-UHFFFAOYSA-N
MDL Number	MFCD03839853
Molecular Formula	C9H7NO3
Molecular Weight	177.1568
SMILES	OC=1C=CC=C2C=C(NC12)C(=O)O
Synonyms	7-Hydroxyindole-2-carboxylic acid, 84639-84-9, 7-Hydroxy-1H-indole-2-carboxylic acid, Q-101962, 7-hydroxy-indole-2-carboxylic acid, 7-Hydroxyindole-2-carboxylicacid, PubChem23489, SCHEMBL2004648, CTK3E6389, DTXSID80601918, ACT10401, ZINC2512939, ANW-48050, CH-157, FCH921095, MFCD03839853, AKOS006346232, AC-1899, 7-oxidanyl-1H-indole-2-carboxylic acid, 1H-Indole-2-carboxylicacid, 7-hydroxy-, AJ-36719, AK-44119, AN-14502, AS-35390, BC215480, BR-44119, OR313008, SC-23210, 1H-Indole-2-carboxylic acid, 7-hydroxy-, AB0007566, AB1007437, AX8022831, DB-031774, TC-061093, FT-0655255, ref dupl: 7-hydroxyindole-2-carboxylic acid, ST24024531, A-2013, H57097, 639H849, A832579, 7-Hydroxy-1H-indole-2-carboxylic acid, AldrichCPR, I10-0281, null, C9H7NO3, H127, A10160, 60032-63-5,

Complexity	219
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	177.043g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	177.159g/mol
Monoisotopic Mass	177.043g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	73.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2

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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