AG00EB4A

647853-32-5 | 3-(2-Hydroxyethyl)phenylboronic acid

AG00EB4A

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CAS Number	647853-32-5
Catalog Number	AG00EB4A(AGN-PC-035OYB)
Chemical Name	3-(2-Hydroxyethyl)phenylboronic acid
IUPAC Name	[3-(2-hydroxyethyl)phenyl]boronic acid
InChI	InChI=1S/C8H11BO3/c10-5-4-7-2-1-3-8(6-7)9(11)12/h1-3,6,10-12H,4-5H2
InChI Key	GCSYFWQBJAJDGY-UHFFFAOYSA-N
MDL Number	MFCD03095123
Molecular Formula	C8H11BO3
Molecular Weight	165.9821
SMILES	OCCC1=CC=CC(=C1)B(O)O
Synonyms	647853-32-5, (3-(2-Hydroxyethyl)phenyl)boronic acid, 3-(2-Hydroxyethyl)benzeneboronic acid, 3-(2-HYDROXYETHYL)PHENYLBORONIc acid, [3-(2-hydroxyethyl)phenyl]boronic acid, MFCD03095123, Boronic acid, [3-(2-hydroxyethyl)phenyl]-, ACMC-209no3, SCHEMBL578581, CTK2F2526, DTXSID30610676, GCSYFWQBJAJDGY-UHFFFAOYSA-N, KS-00000NA2, ANW-34945, AKOS006220914, ZINC169745432, RTX-011832, AK-77608, DS-17181, Boronicacid,b-[3-(2-hydroxyethyl)phenyl]-, FT-0688856, ST24034249, X4667, Boronicacid, B-[3-(2-hydroxyethyl)phenyl]-, B-8254, I04-2984, C8H11BO3, ACN-046551,

Complexity	130
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	166.08g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	165.983g/mol
Monoisotopic Mass	166.08g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	60.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

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

Lot Number