AG006IRF

685514-61-8 | (2,3-Dihydrobenzofuran-7-yl)boronic acid

AG006IRF

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CAS Number	685514-61-8
Catalog Number	AG006IRF(AGN-PC-00Z4XB)
Chemical Name	(2,3-Dihydrobenzofuran-7-yl)boronic acid
IUPAC Name	2,3-dihydro-1-benzofuran-7-ylboronic acid
InChI	InChI=1S/C8H9BO3/c10-9(11)7-3-1-2-6-4-5-12-8(6)7/h1-3,10-11H,4-5H2
InChI Key	JDOYUFYZFXCQJP-UHFFFAOYSA-N
MDL Number	MFCD06801700
Molecular Formula	C8H9BO3
Molecular Weight	163.9663
SMILES	OB(C1=C(OCC2)C2=CC=C1)O
Synonyms	685514-61-8, (2,3-Dihydrobenzofuran-7-yl)boronic acid, 2,3-Dihydro-1-benzofuran-7-boronic acid, 2,3-DIHYDRO-1-BENZOFURAN-7-YLBORONIC ACID, (2,3-dihydro-1-benzofuran-7-yl)boronic acid, Boronic acid, (2,3-dihydro-7-benzofuranyl)-, ACMC-1B9KL, SCHEMBL1516587, CTK1J1977, DTXSID70586048, JDOYUFYZFXCQJP-UHFFFAOYSA-N, ALBB-026380, BCP07166, ANW-35514, MFCD06801700, AKOS004911276, ZINC169746701, AB30111, AK-85478, AS-30669, 2,3-Dihydro-1-benzofuran -7-boronic acid, AB0028843, D2634M500, DB-074040, TR-037486, CS-0030602, FT-0744332, ST24020130, X0940, B-8271, Boronic acid, B-(2,3-dihydro-7-benzofuranyl)-, I01-11817, C8H9BO3, BENZOFURAN-7-BORONIC ACID, (2,3-Dihydrobenzofuran-7-yl)boronicacid, 2,3-DIHYDRO-1-BENZOFURAN-7-BORONICACID, 860625-79-2,

Complexity	162
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	164.064g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	163.967g/mol
Monoisotopic Mass	164.064g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	49.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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