AG003J5Y

25487-66-5 | 3-Boronobenzoic acid

AG003J5Y

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CAS Number	25487-66-5
Catalog Number	AG003J5Y(AGN-PC-0KK6A4)
Chemical Name	3-Boronobenzoic acid
IUPAC Name	3-boronobenzoic acid
InChI	InChI=1S/C7H7BO4/c9-7(10)5-2-1-3-6(4-5)8(11)12/h1-4,11-12H,(H,9,10)
InChI Key	DBVFWZMQJQMJCB-UHFFFAOYSA-N
MDL Number	MFCD00036833
Molecular Formula	C7H7BO4
Molecular Weight	165.9391
SMILES	B(O)(O)C=1C=C(C(=O)O)C=CC1
Synonyms	3-Carboxyphenylboronic acid, 25487-66-5, 3-Boronobenzoic acid, 3-(dihydroxyboranyl)benzoic acid, 3-Carboxybenzeneboronic Acid, m-Carboxyphenylboronic acid, Benzoic acid, 3-borono-, MFCD00036833, 3-(dihydroxyborane)benzoic acid, 3-Carboxyphenylboronicacid, 3-(DIHYDROXYBORYL)BENZOIC ACID, 3-phenyl ester boronic acid, (3-carboxyphenyl)boronic acid, 3-carboxy-phenyl-boronic acid, CHEMBL421765, 3-Carboxyphenylboronic acid, 97%, zlchem 425, PubChem1773, 3-borono-benzoic acid, ACMC-1CMDG, 3-carboxyphenyboronic acid, AC1MC01N, m-carboxyphenyl boronic acid, SCHEMBL6684, 3-carboxy phenylboronic acid, 3-carboxyphenyl boronic acid, 3-carboxyphenyl-boronic acid, KSC201S0H, 3-(carboxy)phenylboronic acid, 3-carboxy-phenyl boronic acid, 3-carboxy benzene boronic acid, CAR032, Jsp005051, CTK1A1903, ZLC0281, DBVFWZMQJQMJCB-UHFFFAOYSA-N, HT720, AC1Q7163, ACN-S003916, ACT02181, ALBB-006101, BCP26995, ANW-25738, BDBM50067893, SBB048065, STK499959, AKOS000264855, ZINC169743198, AB01578, AC-2892, AS-2283, CS-W019968, LS00150, RP09074, RTC-061011, TRA0035448, VB10123, NCGC00249471-01, AK-34376, AN-13488, BC000288, BP-10085, EN003127, FS000841, SC-02916, SY003279, 25487-66-5 3-Carboxyphenylboronic acid, AB0010258, AB1004661, DB-025036, TC-061011, TL8002069, AM20040035, FT-0083593, FT-0601781, ST24032590, EN300-78437, C-1065, MFCD00036833 (97+%), 3-Carboxybenzeneboronic acid; 3-Boronobenzoic acid, 487C665, I01-0813, J-512161, F0001-0854, Z1741960583, Benzoic acid, m-borono-, D02KJI, m-Carboxybenzeneboronic acid, C7H7BO4, cc-150, (3-formyloxyphenyl)boronic acid, 3-Carboxybenzeneboronic acid 1g, Benzeneboronic acid, m-carboxy-, C7-H7-B-O4, ACN-036602, CID2733957, BRN 2967400, CID 2733957, 3-Carboxyphenylboronic acid, 98% - 1G 1g, C2028, 3-16-00-01283 (Beilstein Handbook Reference),

Complexity	171
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	166.044g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	165.939g/mol
Monoisotopic Mass	166.044g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	77.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

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

Lot Number