AG002FBU

19155-88-5 | 2,1,3-Benzoxadiazole-5-carboxylic acid

AG002FBU

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CAS Number	19155-88-5
Catalog Number	AG002FBU(AGN-PC-0KK73Z)
Chemical Name	2,1,3-Benzoxadiazole-5-carboxylic acid
IUPAC Name	2,1,3-benzoxadiazole-5-carboxylic acid
InChI	InChI=1S/C7H4N2O3/c10-7(11)4-1-2-5-6(3-4)9-12-8-5/h1-3H,(H,10,11)
InChI Key	WZUFYJFTOVGJJT-UHFFFAOYSA-N
MDL Number	MFCD00276977
Molecular Formula	C7H4N2O3
Molecular Weight	164.1183
SMILES	N=1ON=C2C1C=CC(=C2)C(=O)O
Synonyms	2,1,3-Benzoxadiazole-5-carboxylic acid, 19155-88-5, Benzo[c][1,2,5]oxadiazole-5-carboxylic acid, Benzofurazan-5-carboxylic acid, 5-Benzofurazancarboxylic acid, WZUFYJFTOVGJJT-UHFFFAOYSA-N, benzo[c]1,2,5-oxadiazole-5-carboxylic acid, PubChem3995, CDS1_000299, AC1MC3CJ, Maybridge1_002587, DivK1c_001339, SCHEMBL548490, 4-Bromo-2,6-dimethylanisole,, Benzoxadiazole-5-carboxylic acid, CTK0H9364, HMS548N13, KS-00003SDY, DTXSID20370732, ZINC158671, ZERO/005740, MFCD00276977, SBB013632, STK688173, AKOS002664672, 2,1,3-Benzoxadiazole-5-carboxylicacid, AC-7713, AN-8721, CS-W008732, MCULE-8251488447, QC-1365, RP02345, TRA-0184469, A255, AJ-15296, AK114608, SC-02076, TS-00121, benzo[1,2,5]oxadiazole-5-carboxylic acid, benzo[2,1,3]oxadiazole-5-carboxylic acid, [2,1,3]-benzoxadiazole-5-carboxylic acid, AB0040498, ST2419120, ST4127291, TR-008887, 4CH-014089, AM20030248, BB 0260620, FT-0609012, Y8109, M-9693, 155B885, AS-710/42568629, J-640195, J-800196, W-206411, 2,1,3-Benzoxadiazole-5-carboxylic acid, 97% (GC), F2173-1241, Z1741958365, (S,S)-Butane-2,3-diol, (S,S)-2,3-Butylene glycol, C7H4N2O3, (2S,3S)-(+)-2,3-Butanediol, CID2735454, 1,2,3-BENZOXADIAZOLE-5-CARBOXYLIC ACID, 2,1,3-Benzoxadiazole-5-carboxylic acid, 97% 500mg, 2,1,3-Benzoxadiazole-5-carboxylic acid, 97% - 1G 1g,

Complexity	197
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	164.022g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	164.12g/mol
Monoisotopic Mass	164.022g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	76.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.7

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