AG003AGJ

1187190-70-0 | 1,3-Dihydro-1-hydroxy-2,1-benzoxaborol-5-ol

AG003AGJ

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CAS Number	1187190-70-0
Catalog Number	AG003AGJ(AGN-PC-0WOFUZ)
Chemical Name	1,3-Dihydro-1-hydroxy-2,1-benzoxaborol-5-ol
IUPAC Name	1-hydroxy-3H-2,1-benzoxaborol-5-ol
InChI	InChI=1S/C7H7BO3/c9-6-1-2-7-5(3-6)4-11-8(7)10/h1-3,9-10H,4H2
InChI Key	GEQGETTVGJBBOI-UHFFFAOYSA-N
MDL Number	MFCD22393581
Molecular Formula	C7H7BO3
Molecular Weight	149.9397
SMILES	OB1OCC2=C1C=CC(=C2)O
Synonyms	1,3-dihydro-2,1-benzoxaborole-1,5-diol, 1187190-70-0, Benzo[c][1,2]oxaborole-1,5(3H)-diol, SCHEMBL564786, GEQGETTVGJBBOI-UHFFFAOYSA-N, MFCD22393581, AKOS030238856, ZINC199928976, 1-hydroxy-3H-2,1-benzoxaborol-5-ol, ACN-054111, 3H-benzo[c][1,2]oxaborole-1,5-diol, KS-000005I0, AS-52943, CS-0052741, FT-0718815, 1,3-Dihydro-1-hydroxy-2,1-benzoxaborol-5-ol, 1196473-37-6,

Complexity	153
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	150.049g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	149.94g/mol
Monoisotopic Mass	150.049g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	49.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H302-H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

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