AG003O2X

23814-12-2 | 1H-Benzo[d][1,2,3]triazole-5-carboxylic acid

AG003O2X

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CAS Number	23814-12-2
Catalog Number	AG003O2X(AGN-PC-09TD8G)
Chemical Name	1H-Benzo[d][1,2,3]triazole-5-carboxylic acid
EC Number	262-527-4
IUPAC Name	2H-benzotriazole-5-carboxylic acid
InChI	InChI=1S/C7H5N3O2/c11-7(12)4-1-2-5-6(3-4)9-10-8-5/h1-3H,(H,11,12)(H,8,9,10)
InChI Key	GUOVBFFLXKJFEE-UHFFFAOYSA-N
MDL Number	MFCD00012318
Molecular Formula	C7H5N3O2
Molecular Weight	163.1335
SMILES	O=C(C1=CC=C(NN=N2)C2=C1)O
Synonyms	1H-benzotriazole-5-carboxylic acid, benzotriazole-5-COOH, 23814-12-2, Benzotriazole-5-carboxylic acid, 1H-Benzo[d][1,2,3]triazole-5-carboxylic acid, 1H-Benzotriazole-5-carboxylic acid, 1H-1,2,3-Benzotriazole-5-Carboxylic Acid, 2H-Benzo[d][1,2,3]triazole-5-carboxylic acid, 5-Carboxybenzotriazole, 1H-BENZO[D][1,2,3]TRIAZOLE-6-CARBOXYLIC ACID, 49636-03-5, 2H-benzotriazole-5-carboxylic acid, 1H-Benzotriazolecarboxylic acid, 1H-benzotriazole-6-carboxylic acid, 1H-1,2,3-benzotriazole-6-carboxylic acid, benzotriazole-6-carboxylic acid, 1288339-47-8, GUOVBFFLXKJFEE-UHFFFAOYSA-N, 3H-Benzotriazole-5-carboxylic acid, MFCD00012318, Benzotriazole-5-cooh, 1h-benzotriazol-5-carbons, Benzotriazole-5-carboxylicacid, EINECS 262-527-4, 5-carboxy-benzotriazole, PubChem19500, AC1L2IYH, Maybridge1_002501, AC1Q5U2N, AC1Q73UH, Oprea1_101982, Oprea1_856379, 5-Benzotriazolecarboxylic Acid, DivK1c_001253, SCHEMBL119640, CHEMBL373015, Jsp004768, CTK7I8537, HMS548J15, KS-00000CAK, STR04366, ANW-48381, BBL012552, MFCD22123440, SBB003927, SC4277, STK396305, ZINC19702063, AKOS000104185, AKOS000268867, Benzotriazole-5-carboxylic acid, 99%, AC-1702, CB-1134, CS-W019369, MCULE-3977644681, CDS1_000213, NCGC00334824-01, AJ-74271, AK-77748, AN-14693, BAS 00015436, BC211192, BP-12376, BR-77748, SC-13679, SY002052, TS-00111, U808, AB1001303, ST2408894, TC-137126, B3869, BB 0217050, FT-0607864, FT-0694365, ST50135922, J3.549.803F, 3H-Benzotriazole-5-carboxylic acid, AldrichCPR, M-2977, AB01105617-03, MFCD00012318 (97+%), 1H-benzo[d]-[1,2,3]triazole-5-carboxylic acid, I04-0523, J-015223, F1791-0657, null, C7H5N3O2, C7-H5-N3-O2, CID72917, AR-1C3333, 5-Carboxybenzotriazole, 97% - 25G 25g, 60932-58-3, 1H-1,2,3-BENZOTRIAZOLE-5-CARBOXYLICACID, C062152, N/A, 6265-75-4,

Complexity	197
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	163.038g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	163.136g/mol
Monoisotopic Mass	163.038g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	78.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.5

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

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