AG001LDT

149105-19-1 | Benzoic acid, 2-borono-

AG001LDT

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CAS Number	149105-19-1
Catalog Number	AG001LDT(AGN-PC-0KK6AP)
Chemical Name	Benzoic acid, 2-borono-
IUPAC Name	2-boronobenzoic acid
InChI	InChI=1S/C7H7BO4/c9-7(10)5-3-1-2-4-6(5)8(11)12/h1-4,11-12H,(H,9,10)
InChI Key	KWNPRVWFJOSGMZ-UHFFFAOYSA-N
MDL Number	MFCD15141948
Molecular Formula	C7H7BO4
Molecular Weight	165.9391
SMILES	O=C(O)C1=CC=CC=C1B(O)O
Synonyms	2-Carboxyphenylboronic acid, 2-boronobenzoic acid, 149105-19-1, 2-Carboxybenzeneboronic Acid, 2-(dihydroxyboranyl)benzoic acid, Benzoic acid, 2-borono-, (2-dihydroxyboronyl)benzoic acid, MFCD01318118, 2-(dihydroxyboryl)benzoic acid, 2-Carboxyphenylboronicacid, Borobenzoesaure, PubChem5201, carboxybenzene boronic acid, o-carboxyphenylboronic acid, 2-CarboxybenzeneboronicAcid, ACMC-209d1w, AC1MC03Z, (2-carboxyphenyl)boronic acid, 2-carboxy-phenyl-boronic acid, SCHEMBL132959, Jsp002816, CTK0H4519, KS-00000APE, DTXSID50370068, KWNPRVWFJOSGMZ-UHFFFAOYSA-N, BM403, AC1Q7133, ACT04748, ALBB-006115, BCP03519, STR07417, ANW-21186, CC-406, SBB048070, STK503717, AKOS000264717, ZINC169744855, AB08634, AC-1543, CS-W000876, LS10794, MCULE-2654185147, RP02443, RTC-061010, TRA0007540, 2-carboxyphenylboronic acid, AldrichCPR, NCGC00249488-01, AK-33370, AN-14842, BC210262, BR-33370, SC-01237, SY002442, AB0011249, DB-012340, TC-061010, TL8001070, 4CH-001155, AM20060970, FT-0084835, FT-0611651, ST24032392, MFCD01318118 (95%), B-3128, 105C191, I01-3198, Q-102200, 2-carboxybenzene boronic acid, carboxyphenylboronic acid, C7H7BO4, ACN-032487, CID2733985, 2-Carboxybenzeneboronic acid, 95% 250mg, (1,3-dimethyl-1H-pyrazol-4-yl)methylamine, 2-Carboxyphenylboronic acid, 98% - 1G 1g, A3272, C2501, 42826-42-6,

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 statements	H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

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